N-(2-aminocarbonylphenyl)-1-[(4-methylphenyl)methylsulfonyl]piperidine-4-carboxamide

Systemtic Name: N-(2-aminocarbonylphenyl)-1-[(4-methylphenyl)methylsulfonyl]piperidine-4-carboxamide Openeye Name: N-(2-carbamoylphenyl)-1-(p-tolylmethylsulfonyl)piperidine-4-carboxamide CAS Name: N-(2-carbamoylphenyl)-1-[(4-methylphenyl)methylsulfonyl]-4-piperidinecarboxamide IUPAC Name: N-(2-carbamoylphenyl)-1-[(4-methylphenyl)methylsulfonyl]piperidine-4-carboxamide Traditional Name: N-(2-carbamoylphenyl)-1-(4-methylbenzyl)sulfonyl-isonipecotamide Formula: C21H25N3O4S MolecularWeight: 415.5059

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CS(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=CC=C3C(=O)N

Isomeric SMILES

CC1=CC=C(C=C1)CS(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=CC=C3C(=O)N

InChI

InChI=1S/C21H25N3O4S/c1-15-6-8-16(9-7-15)14-29(27,28)24-12-10-17(11-13-24)21(26)23-19-5-3-2-4-18(19)20(22)25/h2-9,17H,10-14H2,1H3,(H2,22,25)(H,23,26)