1-(5-aminocarbonyl-1-methyl-pyrrol-3-yl)sulfonyl-N-[(4-methylphenyl)-phenyl-methyl]piperidine-4-carboxamide

Systemtic Name: 1-(5-aminocarbonyl-1-methyl-pyrrol-3-yl)sulfonyl-N-[(4-methylphenyl)-phenyl-methyl]piperidine-4-carboxamide Openeye Name: 1-(5-carbamoyl-1-methyl-pyrrol-3-yl)sulfonyl-N-[phenyl(p-tolyl)methyl]piperidine-4-carboxamide CAS Name: 1-[(5-carbamoyl-1-methyl-3-pyrrolyl)sulfonyl]-N-[(4-methylphenyl)-phenylmethyl]-4-piperidinecarboxamide IUPAC Name: 1-(5-carbamoyl-1-methylpyrrol-3-yl)sulfonyl-N-[(4-methylphenyl)-phenylmethyl]piperidine-4-carboxamide Traditional Name: 1-(5-carbamoyl-1-methyl-pyrrol-3-yl)sulfonyl-N-[phenyl(p-tolyl)methyl]isonipecotamide Formula: C26H30N4O4S MolecularWeight: 494.6058

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=CC=CC=C2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CN(C(=C4)C(=O)N)C

Isomeric SMILES

CC1=CC=C(C=C1)C(C2=CC=CC=C2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CN(C(=C4)C(=O)N)C

InChI

InChI=1S/C26H30N4O4S/c1-18-8-10-20(11-9-18)24(19-6-4-3-5-7-19)28-26(32)21-12-14-30(15-13-21)35(33,34)22-16-23(25(27)31)29(2)17-22/h3-11,16-17,21,24H,12-15H2,1-2H3,(H2,27,31)(H,28,32)