1-(2,4-dimethylphenyl)sulfonyl-N-[(R)-phenyl(thiophen-2-yl)methyl]piperidine-4-carboxamide

Systemtic Name: 1-(2,4-dimethylphenyl)sulfonyl-N-[(R)-phenyl(thiophen-2-yl)methyl]piperidine-4-carboxamide Openeye Name: 1-(2,4-dimethylphenyl)sulfonyl-N-[(R)-phenyl(2-thienyl)methyl]piperidine-4-carboxamide CAS Name: 1-(2,4-dimethylphenyl)sulfonyl-N-[(R)-phenyl(thiophen-2-yl)methyl]-4-piperidinecarboxamide IUPAC Name: 1-(2,4-dimethylphenyl)sulfonyl-N-[(R)-phenyl(thiophen-2-yl)methyl]piperidine-4-carboxamide Traditional Name: 1-(2,4-dimethylphenyl)sulfonyl-N-[(R)-phenyl(2-thienyl)methyl]isonipecotamide Formula: C25H28N2O3S2 MolecularWeight: 468.63142

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC(C3=CC=CC=C3)C4=CC=CS4)C

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N[C@H](C3=CC=CC=C3)C4=CC=CS4)C

InChI

InChI=1S/C25H28N2O3S2/c1-18-10-11-23(19(2)17-18)32(29,30)27-14-12-21(13-15-27)25(28)26-24(22-9-6-16-31-22)20-7-4-3-5-8-20/h3-11,16-17,21,24H,12-15H2,1-2H3,(H,26,28)/t24-/m1/s1