N-[(4-methylphenyl)methyl]-1-quinolin-8-ylsulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[(4-methylphenyl)methyl]-1-quinolin-8-ylsulfonyl-piperidine-3-carboxamide Openeye Name: N-(p-tolylmethyl)-1-(8-quinolylsulfonyl)piperidine-3-carboxamide CAS Name: N-[(4-methylphenyl)methyl]-1-(8-quinolinylsulfonyl)-3-piperidinecarboxamide IUPAC Name: N-[(4-methylphenyl)methyl]-1-quinolin-8-ylsulfonylpiperidine-3-carboxamide Traditional Name: N-(4-methylbenzyl)-1-(8-quinolylsulfonyl)nipecotamide Formula: C23H25N3O3S MolecularWeight: 423.5279

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=CC4=C3N=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C23H25N3O3S/c1-17-9-11-18(12-10-17)15-25-23(27)20-7-4-14-26(16-20)30(28,29)21-8-2-5-19-6-3-13-24-22(19)21/h2-3,5-6,8-13,20H,4,7,14-16H2,1H3,(H,25,27)