1-(1H-indol-5-ylsulfonyl)-N-[(4-methylsulfanylphenyl)methyl]piperidine-4-carboxamide

Systemtic Name: 1-(1H-indol-5-ylsulfonyl)-N-[(4-methylsulfanylphenyl)methyl]piperidine-4-carboxamide Openeye Name: 1-(1H-indol-5-ylsulfonyl)-N-[(4-methylsulfanylphenyl)methyl]piperidine-4-carboxamide CAS Name: 1-(1H-indol-5-ylsulfonyl)-N-[[4-(methylthio)phenyl]methyl]-4-piperidinecarboxamide IUPAC Name: 1-(1H-indol-5-ylsulfonyl)-N-[(4-methylsulfanylphenyl)methyl]piperidine-4-carboxamide Traditional Name: 1-(1H-indol-5-ylsulfonyl)-N-[4-(methylthio)benzyl]isonipecotamide Formula: C22H25N3O3S2 MolecularWeight: 443.5822

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)CNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)NC=C4

Isomeric SMILES

CSC1=CC=C(C=C1)CNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)NC=C4

InChI

InChI=1S/C22H25N3O3S2/c1-29-19-4-2-16(3-5-19)15-24-22(26)17-9-12-25(13-10-17)30(27,28)20-6-7-21-18(14-20)8-11-23-21/h2-8,11,14,17,23H,9-10,12-13,15H2,1H3,(H,24,26)