N-[(2S)-1-oxidanylidene-3-(4-phenoxyphenyl)sulfanyl-1-piperidin-1-yl-propan-2-yl]ethanamide

Systemtic Name: N-[(2S)-1-oxidanylidene-3-(4-phenoxyphenyl)sulfanyl-1-piperidin-1-yl-propan-2-yl]ethanamide Openeye Name: N-[(1S)-2-oxo-1-[(4-phenoxyphenyl)sulfanylmethyl]-2-(1-piperidyl)ethyl]acetamide CAS Name: N-[(2S)-1-oxo-3-[(4-phenoxyphenyl)thio]-1-(1-piperidinyl)propan-2-yl]acetamide IUPAC Name: N-[(2S)-1-oxo-3-(4-phenoxyphenyl)sulfanyl-1-piperidin-1-ylpropan-2-yl]acetamide Traditional Name: N-[(1S)-2-keto-1-[[(4-phenoxyphenyl)thio]methyl]-2-piperidino-ethyl]acetamide Formula: C22H26N2O3S MolecularWeight: 398.51844

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CSC1=CC=C(C=C1)OC2=CC=CC=C2)C(=O)N3CCCCC3

Isomeric SMILES

CC(=O)N[C@H](CSC1=CC=C(C=C1)OC2=CC=CC=C2)C(=O)N3CCCCC3

InChI

InChI=1S/C22H26N2O3S/c1-17(25)23-21(22(26)24-14-6-3-7-15-24)16-28-20-12-10-19(11-13-20)27-18-8-4-2-5-9-18/h2,4-5,8-13,21H,3,6-7,14-16H2,1H3,(H,23,25)/t21-/m1/s1