(3S)-1-(4-methoxyphenyl)sulfonyl-N-(4-propan-2-ylphenyl)piperidine-3-carboxamide

Systemtic Name: (3S)-1-(4-methoxyphenyl)sulfonyl-N-(4-propan-2-ylphenyl)piperidine-3-carboxamide Openeye Name: (3S)-N-(4-isopropylphenyl)-1-(4-methoxyphenyl)sulfonyl-piperidine-3-carboxamide CAS Name: (3S)-1-(4-methoxyphenyl)sulfonyl-N-(4-propan-2-ylphenyl)-3-piperidinecarboxamide IUPAC Name: (3S)-1-(4-methoxyphenyl)sulfonyl-N-(4-propan-2-ylphenyl)piperidine-3-carboxamide Traditional Name: (3S)-1-(4-methoxyphenyl)sulfonyl-N-p-cumenyl-nipecotamide Formula: C22H28N2O4S MolecularWeight: 416.53372

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC(=O)[C@H]2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H28N2O4S/c1-16(2)17-6-8-19(9-7-17)23-22(25)18-5-4-14-24(15-18)29(26,27)21-12-10-20(28-3)11-13-21/h6-13,16,18H,4-5,14-15H2,1-3H3,(H,23,25)/t18-/m0/s1