ethyl 6-[[5-[[5-[[5-[3-(dimethylamino)propylcarbamoyl]-1-methyl-pyrrol-3-yl]carbamoyl]-1-methyl-pyrrol-3-yl]carbamoyl]-1-methyl-pyrrol-3-yl]amino]-6-oxidanylidene-hexanoate

Systemtic Name: ethyl 6-[[5-[[5-[[5-[3-(dimethylamino)propylcarbamoyl]-1-methyl-pyrrol-3-yl]carbamoyl]-1-methyl-pyrrol-3-yl]carbamoyl]-1-methyl-pyrrol-3-yl]amino]-6-oxidanylidene-hexanoate Openeye Name: ethyl 6-[[5-[[5-[[5-[3-(dimethylamino)propylcarbamoyl]-1-methyl-pyrrol-3-yl]carbamoyl]-1-methyl-pyrrol-3-yl]carbamoyl]-1-methyl-pyrrol-3-yl]amino]-6-oxo-hexanoate CAS Name: 6-[[5-[[[5-[[[5-[[3-(dimethylamino)propylamino]-oxomethyl]-1-methyl-3-pyrrolyl]amino]-oxomethyl]-1-methyl-3-pyrrolyl]amino]-oxomethyl]-1-methyl-3-pyrrolyl]amino]-6-oxohexanoic acid ethyl ester IUPAC Name: ethyl 6-[[5-[[5-[[5-[3-(dimethylamino)propylcarbamoyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]amino]-6-oxohexanoate Traditional Name: 6-[[5-[[5-[[5-[3-(dimethylamino)propylcarbamoyl]-1-methyl-pyrrol-3-yl]carbamoyl]-1-methyl-pyrrol-3-yl]carbamoyl]-1-methyl-pyrrol-3-yl]amino]-6-keto-hexanoic acid ethyl ester Formula: C31H44N8O6 MolecularWeight: 624.73106

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCC(=O)NC1=CN(C(=C1)C(=O)NC2=CN(C(=C2)C(=O)NC3=CN(C(=C3)C(=O)NCCCN(C)C)C)C)C

Isomeric SMILES

CCOC(=O)CCCCC(=O)NC1=CN(C(=C1)C(=O)NC2=CN(C(=C2)C(=O)NC3=CN(C(=C3)C(=O)NCCCN(C)C)C)C)C

InChI

InChI=1S/C31H44N8O6/c1-7-45-28(41)12-9-8-11-27(40)33-21-15-25(38(5)18-21)30(43)35-23-17-26(39(6)20-23)31(44)34-22-16-24(37(4)19-22)29(42)32-13-10-14-36(2)3/h15-20H,7-14H2,1-6H3,(H,32,42)(H,33,40)(H,34,44)(H,35,43)