3-methoxy-N-(2-methylphenyl)sulfonyl-4-[1-[5-[(1-propyl-2-sulfanylidene-pyrrolidin-3-yl)methyl]-1H-indol-3-yl]butyl]benzamide

Systemtic Name: 3-methoxy-N-(2-methylphenyl)sulfonyl-4-[1-[5-[(1-propyl-2-sulfanylidene-pyrrolidin-3-yl)methyl]-1H-indol-3-yl]butyl]benzamide Openeye Name: 3-methoxy-N-(o-tolylsulfonyl)-4-[1-[5-[(1-propyl-2-thioxo-pyrrolidin-3-yl)methyl]-1H-indol-3-yl]butyl]benzamide CAS Name: 3-methoxy-N-(2-methylphenyl)sulfonyl-4-[1-[5-[(1-propyl-2-sulfanylidene-3-pyrrolidinyl)methyl]-1H-indol-3-yl]butyl]benzamide IUPAC Name: 3-methoxy-N-(2-methylphenyl)sulfonyl-4-[1-[5-[(1-propyl-2-sulfanylidenepyrrolidin-3-yl)methyl]-1H-indol-3-yl]butyl]benzamide Traditional Name: 3-methoxy-N-(o-tolylsulfonyl)-4-[1-[5-[(1-propyl-2-thioxo-pyrrolidin-3-yl)methyl]-1H-indol-3-yl]butyl]benzamide Formula: C35H41N3O4S2 MolecularWeight: 631.84774

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=C(C=C(C=C1)C(=O)NS(=O)(=O)C2=CC=CC=C2C)OC)C3=CNC4=C3C=C(C=C4)CC5CCN(C5=S)CCC

Isomeric SMILES

CCCC(C1=C(C=C(C=C1)C(=O)NS(=O)(=O)C2=CC=CC=C2C)OC)C3=CNC4=C3C=C(C=C4)CC5CCN(C5=S)CCC

InChI

InChI=1S/C35H41N3O4S2/c1-5-9-27(30-22-36-31-15-12-24(20-29(30)31)19-26-16-18-38(17-6-2)35(26)43)28-14-13-25(21-32(28)42-4)34(39)37-44(40,41)33-11-8-7-10-23(33)3/h7-8,10-15,20-22,26-27,36H,5-6,9,16-19H2,1-4H3,(H,37,39)