4-[[2-[(3S)-3-methylpiperidin-1-yl]-2-oxidanylidene-ethyl]sulfanylmethyl]-N-phenyl-benzamide

Systemtic Name: 4-[[2-[(3S)-3-methylpiperidin-1-yl]-2-oxidanylidene-ethyl]sulfanylmethyl]-N-phenyl-benzamide Openeye Name: 4-[[2-[(3S)-3-methyl-1-piperidyl]-2-oxo-ethyl]sulfanylmethyl]-N-phenyl-benzamide CAS Name: 4-[[[2-[(3S)-3-methyl-1-piperidinyl]-2-oxoethyl]thio]methyl]-N-phenylbenzamide IUPAC Name: 4-[[2-[(3S)-3-methylpiperidin-1-yl]-2-oxoethyl]sulfanylmethyl]-N-phenylbenzamide Traditional Name: 4-[[[2-keto-2-[(3S)-3-methylpiperidino]ethyl]thio]methyl]-N-phenyl-benzamide Formula: C22H26N2O2S MolecularWeight: 382.51904

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)CSCC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

C[C@H]1CCCN(C1)C(=O)CSCC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C22H26N2O2S/c1-17-6-5-13-24(14-17)21(25)16-27-15-18-9-11-19(12-10-18)22(26)23-20-7-3-2-4-8-20/h2-4,7-12,17H,5-6,13-16H2,1H3,(H,23,26)/t17-/m0/s1