5-(1,3-benzodioxol-5-ylmethyl)-2-[[4-(2,3-dihydroindol-1-ylsulfonyl)phenyl]carbonylamino]-4-methyl-thiophene-3-carboxamide

Systemtic Name: 5-(1,3-benzodioxol-5-ylmethyl)-2-[[4-(2,3-dihydroindol-1-ylsulfonyl)phenyl]carbonylamino]-4-methyl-thiophene-3-carboxamide Openeye Name: 5-(1,3-benzodioxol-5-ylmethyl)-2-[(4-indolin-1-ylsulfonylbenzoyl)amino]-4-methyl-thiophene-3-carboxamide CAS Name: 5-(1,3-benzodioxol-5-ylmethyl)-2-[[[4-(2,3-dihydroindol-1-ylsulfonyl)phenyl]-oxomethyl]amino]-4-methyl-3-thiophenecarboxamide IUPAC Name: 5-(1,3-benzodioxol-5-ylmethyl)-2-[[4-(2,3-dihydroindol-1-ylsulfonyl)benzoyl]amino]-4-methylthiophene-3-carboxamide Traditional Name: 2-[(4-indolin-1-ylsulfonylbenzoyl)amino]-4-methyl-5-piperonyl-thiophene-3-carboxamide Formula: C29H25N3O6S2 MolecularWeight: 575.6553

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)N)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCC4=CC=CC=C43)CC5=CC6=C(C=C5)OCO6

Isomeric SMILES

CC1=C(SC(=C1C(=O)N)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCC4=CC=CC=C43)CC5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C29H25N3O6S2/c1-17-25(15-18-6-11-23-24(14-18)38-16-37-23)39-29(26(17)27(30)33)31-28(34)20-7-9-21(10-8-20)40(35,36)32-13-12-19-4-2-3-5-22(19)32/h2-11,14H,12-13,15-16H2,1H3,(H2,30,33)(H,31,34)