N-(2-methylsulfanylphenyl)-4-[2-oxidanylidene-4-(phenylmethyl)-1,3-oxazolidin-3-yl]piperidine-1-carbothioamide

Systemtic Name: N-(2-methylsulfanylphenyl)-4-[2-oxidanylidene-4-(phenylmethyl)-1,3-oxazolidin-3-yl]piperidine-1-carbothioamide Openeye Name: 4-(4-benzyl-2-oxo-oxazolidin-3-yl)-N-(2-methylsulfanylphenyl)piperidine-1-carbothioamide CAS Name: N-[2-(methylthio)phenyl]-4-[2-oxo-4-(phenylmethyl)-3-oxazolidinyl]-1-piperidinecarbothioamide IUPAC Name: 4-(4-benzyl-2-oxo-1,3-oxazolidin-3-yl)-N-(2-methylsulfanylphenyl)piperidine-1-carbothioamide Traditional Name: 4-(4-benzyl-2-keto-oxazolidin-3-yl)-N-[2-(methylthio)phenyl]piperidine-1-carbothioamide Formula: C23H27N3O2S2 MolecularWeight: 441.60938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1NC(=S)N2CCC(CC2)N3C(COC3=O)CC4=CC=CC=C4

Isomeric SMILES

CSC1=CC=CC=C1NC(=S)N2CCC(CC2)N3C(COC3=O)CC4=CC=CC=C4

InChI

InChI=1S/C23H27N3O2S2/c1-30-21-10-6-5-9-20(21)24-22(29)25-13-11-18(12-14-25)26-19(16-28-23(26)27)15-17-7-3-2-4-8-17/h2-10,18-19H,11-16H2,1H3,(H,24,29)