1-(1-methylindol-5-yl)sulfonyl-N-[(4-methylsulfanylphenyl)methyl]piperidine-4-carboxamide

Systemtic Name: 1-(1-methylindol-5-yl)sulfonyl-N-[(4-methylsulfanylphenyl)methyl]piperidine-4-carboxamide Openeye Name: 1-(1-methylindol-5-yl)sulfonyl-N-[(4-methylsulfanylphenyl)methyl]piperidine-4-carboxamide CAS Name: 1-[(1-methyl-5-indolyl)sulfonyl]-N-[[4-(methylthio)phenyl]methyl]-4-piperidinecarboxamide IUPAC Name: 1-(1-methylindol-5-yl)sulfonyl-N-[(4-methylsulfanylphenyl)methyl]piperidine-4-carboxamide Traditional Name: 1-(1-methylindol-5-yl)sulfonyl-N-[4-(methylthio)benzyl]isonipecotamide Formula: C23H27N3O3S2 MolecularWeight: 457.60878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC2=C1C=CC(=C2)S(=O)(=O)N3CCC(CC3)C(=O)NCC4=CC=C(C=C4)SC

Isomeric SMILES

CN1C=CC2=C1C=CC(=C2)S(=O)(=O)N3CCC(CC3)C(=O)NCC4=CC=C(C=C4)SC

InChI

InChI=1S/C23H27N3O3S2/c1-25-12-9-19-15-21(7-8-22(19)25)31(28,29)26-13-10-18(11-14-26)23(27)24-16-17-3-5-20(30-2)6-4-17/h3-9,12,15,18H,10-11,13-14,16H2,1-2H3,(H,24,27)