N-(1,3-benzodioxol-5-ylmethyl)-2-(3-chlorophenyl)sulfanyl-5-(2,3-dihydroindol-1-ylsulfonyl)benzamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(3-chlorophenyl)sulfanyl-5-(2,3-dihydroindol-1-ylsulfonyl)benzamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(3-chlorophenyl)sulfanyl-5-indolin-1-ylsulfonyl-benzamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(3-chlorophenyl)thio]-5-(2,3-dihydroindol-1-ylsulfonyl)benzamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(3-chlorophenyl)sulfanyl-5-(2,3-dihydroindol-1-ylsulfonyl)benzamide Traditional Name: 2-[(3-chlorophenyl)thio]-5-indolin-1-ylsulfonyl-N-piperonyl-benzamide Formula: C29H23ClN2O5S2 MolecularWeight: 579.08632

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C21)S(=O)(=O)C3=CC(=C(C=C3)SC4=CC(=CC=C4)Cl)C(=O)NCC5=CC6=C(C=C5)OCO6

Isomeric SMILES

C1CN(C2=CC=CC=C21)S(=O)(=O)C3=CC(=C(C=C3)SC4=CC(=CC=C4)Cl)C(=O)NCC5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C29H23ClN2O5S2/c30-21-5-3-6-22(15-21)38-28-11-9-23(39(34,35)32-13-12-20-4-1-2-7-25(20)32)16-24(28)29(33)31-17-19-8-10-26-27(14-19)37-18-36-26/h1-11,14-16H,12-13,17-18H2,(H,31,33)