N-[[2-(2-methylimidazol-1-yl)phenyl]methyl]-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[[2-(2-methylimidazol-1-yl)phenyl]methyl]-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[[2-(2-methylimidazol-1-yl)phenyl]methyl]-1-(2-thienylsulfonyl)piperidine-4-carboxamide CAS Name: N-[[2-(2-methyl-1-imidazolyl)phenyl]methyl]-1-thiophen-2-ylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-[[2-(2-methylimidazol-1-yl)phenyl]methyl]-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-[2-(2-methylimidazol-1-yl)benzyl]-1-(2-thienylsulfonyl)isonipecotamide Formula: C21H24N4O3S2 MolecularWeight: 444.57026

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CN1C2=CC=CC=C2CNC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

CC1=NC=CN1C2=CC=CC=C2CNC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C21H24N4O3S2/c1-16-22-10-13-25(16)19-6-3-2-5-18(19)15-23-21(26)17-8-11-24(12-9-17)30(27,28)20-7-4-14-29-20/h2-7,10,13-14,17H,8-9,11-12,15H2,1H3,(H,23,26)