N-(3-methylphenyl)-1-quinolin-8-ylsulfonyl-piperidine-3-carboxamide

Systemtic Name: N-(3-methylphenyl)-1-quinolin-8-ylsulfonyl-piperidine-3-carboxamide Openeye Name: N-(m-tolyl)-1-(8-quinolylsulfonyl)piperidine-3-carboxamide CAS Name: N-(3-methylphenyl)-1-(8-quinolinylsulfonyl)-3-piperidinecarboxamide IUPAC Name: N-(3-methylphenyl)-1-quinolin-8-ylsulfonylpiperidine-3-carboxamide Traditional Name: N-(m-tolyl)-1-(8-quinolylsulfonyl)nipecotamide Formula: C22H23N3O3S MolecularWeight: 409.50132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23N3O3S/c1-16-6-2-10-19(14-16)24-22(26)18-9-5-13-25(15-18)29(27,28)20-11-3-7-17-8-4-12-23-21(17)20/h2-4,6-8,10-12,14,18H,5,9,13,15H2,1H3,(H,24,26)