N-[5-[[4-[[5-[[5-[[3-[[5-[[5-[[3-[3-(dimethylamino)propylamino]-3-oxidanylidene-propyl]carbamoyl]-1-methyl-pyrrol-3-yl]carbamoyl]-1-methyl-pyrrol-3-yl]amino]-3-oxidanylidene-propyl]carbamoyl]-1-methyl-pyrrol-3-yl]carbamoyl]-1-methyl-pyrrol-3-yl]amino]-4-oxidanylidene-butyl]carbamoyl]-1-methyl-pyrrol-3-yl]-1-methyl-imidazole-2-carboxamide; ethanoic acid

Systemtic Name: N-[5-[[4-[[5-[[5-[[3-[[5-[[5-[[3-[3-(dimethylamino)propylamino]-3-oxidanylidene-propyl]carbamoyl]-1-methyl-pyrrol-3-yl]carbamoyl]-1-methyl-pyrrol-3-yl]amino]-3-oxidanylidene-propyl]carbamoyl]-1-methyl-pyrrol-3-yl]carbamoyl]-1-methyl-pyrrol-3-yl]amino]-4-oxidanylidene-butyl]carbamoyl]-1-methyl-pyrrol-3-yl]-1-methyl-imidazole-2-carboxamide; ethanoic acid Openeye Name: acetic acid; N-[5-[[4-[[5-[[5-[[3-[[5-[[5-[[3-[3-(dimethylamino)propylamino]-3-oxo-propyl]carbamoyl]-1-methyl-pyrrol-3-yl]carbamoyl]-1-methyl-pyrrol-3-yl]amino]-3-oxo-propyl]carbamoyl]-1-methyl-pyrrol-3-yl]carbamoyl]-1-methyl-pyrrol-3-yl]amino]-4-oxo-butyl]carbamoyl]-1-methyl-pyrrol-3-yl]-1-methyl-imidazole-2-carboxamide CAS Name: acetic acid; N-[5-[[[4-[[5-[[[5-[[[3-[[5-[[[5-[[[3-[3-(dimethylamino)propylamino]-3-oxopropyl]amino]-oxomethyl]-1-methyl-3-pyrrolyl]amino]-oxomethyl]-1-methyl-3-pyrrolyl]amino]-3-oxopropyl]amino]-oxomethyl]-1-methyl-3-pyrrolyl]amino]-oxomethyl]-1-methyl-3-pyrrolyl]amino]-4-oxobutyl]amino]-oxomethyl]-1-methyl-3-pyrrolyl]-1-methyl-2-imidazolecarboxamide IUPAC Name: acetic acid; N-[5-[[4-[[5-[[5-[[3-[[5-[[5-[[3-[3-(dimethylamino)propylamino]-3-oxopropyl]carbamoyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]amino]-3-oxopropyl]carbamoyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]amino]-4-oxobutyl]carbamoyl]-1-methylpyrrol-3-yl]-1-methylimidazole-2-carboxamide Traditional Name: acetic acid; N-[5-[[4-[[5-[[5-[[3-[[5-[[5-[[3-[3-(dimethylamino)propylamino]-3-keto-propyl]carbamoyl]-1-methyl-pyrrol-3-yl]carbamoyl]-1-methyl-pyrrol-3-yl]amino]-3-keto-propyl]carbamoyl]-1-methyl-pyrrol-3-yl]carbamoyl]-1-methyl-pyrrol-3-yl]amino]-4-keto-butyl]carbamoyl]-1-methyl-pyrrol-3-yl]-1-methyl-imidazole-2-carboxamide Formula: C52H69N17O11 MolecularWeight: 1108.21156

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)O.CN1C=CN=C1C(=O)NC2=CN(C(=C2)C(=O)NCCCC(=O)NC3=CN(C(=C3)C(=O)NC4=CN(C(=C4)C(=O)NCCC(=O)NC5=CN(C(=C5)C(=O)NC6=CN(C(=C6)C(=O)NCCC(=O)NCCCN(C)C)C)C)C)C)C

Isomeric SMILES

CC(=O)O.CN1C=CN=C1C(=O)NC2=CN(C(=C2)C(=O)NCCCC(=O)NC3=CN(C(=C3)C(=O)NC4=CN(C(=C4)C(=O)NCCC(=O)NC5=CN(C(=C5)C(=O)NC6=CN(C(=C6)C(=O)NCCC(=O)NCCCN(C)C)C)C)C)C)C

InChI

InChI=1S/C50H65N17O9.C2H4O2/c1-61(2)19-10-15-51-41(68)12-16-54-46(72)37-23-33(28-63(37)4)59-49(75)40-22-32(27-67(40)8)57-43(70)13-17-55-47(73)38-24-34(29-64(38)5)58-48(74)39-21-31(26-66(39)7)56-42(69)11-9-14-53-45(71)36-25-35(30-65(36)6)60-50(76)44-52-18-20-62(44)3;1-2(3)4/h18,20-30H,9-17,19H2,1-8H3,(H,51,68)(H,53,71)(H,54,72)(H,55,73)(H,56,69)(H,57,70)(H,58,74)(H,59,75)(H,60,76);1H3,(H,3,4)