N-[5-[[5-[3-(dimethylamino)propylcarbamoyl]-1-[(2S,3R,4R,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]pyrrol-3-yl]carbamoyl]-1-[(2S,3R,4R,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]pyrrol-3-yl]-4-methyl-1,3-thiazole-5-carboxamide

Systemtic Name: N-[5-[[5-[3-(dimethylamino)propylcarbamoyl]-1-[(2S,3R,4R,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]pyrrol-3-yl]carbamoyl]-1-[(2S,3R,4R,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]pyrrol-3-yl]-4-methyl-1,3-thiazole-5-carboxamide Openeye Name: N-[5-[[5-[3-(dimethylamino)propylcarbamoyl]-1-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]pyrrol-3-yl]carbamoyl]-1-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]pyrrol-3-yl]-4-methyl-thiazole-5-carboxamide CAS Name: N-[5-[[[5-[[3-(dimethylamino)propylamino]-oxomethyl]-1-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]-3-pyrrolyl]amino]-oxomethyl]-1-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]-3-pyrrolyl]-4-methyl-5-thiazolecarboxamide IUPAC Name: N-[5-[[5-[3-(dimethylamino)propylcarbamoyl]-1-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]pyrrol-3-yl]carbamoyl]-1-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]pyrrol-3-yl]-4-methyl-1,3-thiazole-5-carboxamide Traditional Name: N-[5-[[5-[3-(dimethylamino)propylcarbamoyl]-1-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl]pyrrol-3-yl]carbamoyl]-1-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl]pyrrol-3-yl]-4-methyl-thiazole-5-carboxamide Formula: C32H45N7O13S MolecularWeight: 767.8038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=N1)C(=O)NC2=CN(C(=C2)C(=O)NC3=CN(C(=C3)C(=O)NCCCN(C)C)C4C(C(C(C(O4)CO)O)O)O)C5C(C(C(C(O5)CO)O)O)O

Isomeric SMILES

CC1=C(SC=N1)C(=O)NC2=CN(C(=C2)C(=O)NC3=CN(C(=C3)C(=O)NCCCN(C)C)[C@@H]4[C@@H]([C@@H]([C@@H]([C@H](O4)CO)O)O)O)[C@@H]5[C@@H]([C@@H]([C@@H]([C@H](O5)CO)O)O)O

InChI

InChI=1S/C32H45N7O13S/c1-14-27(53-13-34-14)30(50)36-16-8-18(39(10-16)32-26(47)24(45)22(43)20(12-41)52-32)29(49)35-15-7-17(28(48)33-5-4-6-37(2)3)38(9-15)31-25(46)23(44)21(42)19(11-40)51-31/h7-10,13,19-26,31-32,40-47H,4-6,11-12H2,1-3H3,(H,33,48)(H,35,49)(H,36,50)/t19-,20-,21-,22-,23-,24-,25-,26-,31+,32+/m1/s1