N-[4-[(2R,6R)-2,6-dimethylpiperidin-1-yl]sulfonylphenyl]-1-(2-methylphenyl)carbonyl-piperidine-4-carboxamide

Systemtic Name: N-[4-[(2R,6R)-2,6-dimethylpiperidin-1-yl]sulfonylphenyl]-1-(2-methylphenyl)carbonyl-piperidine-4-carboxamide Openeye Name: N-[4-[[(2R,6R)-2,6-dimethyl-1-piperidyl]sulfonyl]phenyl]-1-(2-methylbenzoyl)piperidine-4-carboxamide CAS Name: N-[4-[[(2R,6R)-2,6-dimethyl-1-piperidinyl]sulfonyl]phenyl]-1-[(2-methylphenyl)-oxomethyl]-4-piperidinecarboxamide IUPAC Name: N-[4-[(2R,6R)-2,6-dimethylpiperidin-1-yl]sulfonylphenyl]-1-(2-methylbenzoyl)piperidine-4-carboxamide Traditional Name: N-[4-[(2R,6R)-2,6-dimethylpiperidino]sulfonylphenyl]-1-o-toluoyl-isonipecotamide Formula: C27H35N3O4S MolecularWeight: 497.6495

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3CCN(CC3)C(=O)C4=CC=CC=C4C)C

Isomeric SMILES

C[C@@H]1CCC[C@H](N1S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3CCN(CC3)C(=O)C4=CC=CC=C4C)C

InChI

InChI=1S/C27H35N3O4S/c1-19-7-4-5-10-25(19)27(32)29-17-15-22(16-18-29)26(31)28-23-11-13-24(14-12-23)35(33,34)30-20(2)8-6-9-21(30)3/h4-5,7,10-14,20-22H,6,8-9,15-18H2,1-3H3,(H,28,31)/t20-,21-/m1/s1