N-(2-methylsulfanylphenyl)-4-[2-oxidanylidene-5-(phenoxymethyl)-1,3-oxazolidin-3-yl]piperidine-1-carbothioamide

Systemtic Name: N-(2-methylsulfanylphenyl)-4-[2-oxidanylidene-5-(phenoxymethyl)-1,3-oxazolidin-3-yl]piperidine-1-carbothioamide Openeye Name: N-(2-methylsulfanylphenyl)-4-[2-oxo-5-(phenoxymethyl)oxazolidin-3-yl]piperidine-1-carbothioamide CAS Name: N-[2-(methylthio)phenyl]-4-[2-oxo-5-(phenoxymethyl)-3-oxazolidinyl]-1-piperidinecarbothioamide IUPAC Name: N-(2-methylsulfanylphenyl)-4-[2-oxo-5-(phenoxymethyl)-1,3-oxazolidin-3-yl]piperidine-1-carbothioamide Traditional Name: 4-[2-keto-5-(phenoxymethyl)oxazolidin-3-yl]-N-[2-(methylthio)phenyl]piperidine-1-carbothioamide Formula: C23H27N3O3S2 MolecularWeight: 457.60878

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1NC(=S)N2CCC(CC2)N3CC(OC3=O)COC4=CC=CC=C4

Isomeric SMILES

CSC1=CC=CC=C1NC(=S)N2CCC(CC2)N3CC(OC3=O)COC4=CC=CC=C4

InChI

InChI=1S/C23H27N3O3S2/c1-31-21-10-6-5-9-20(21)24-22(30)25-13-11-17(12-14-25)26-15-19(29-23(26)27)16-28-18-7-3-2-4-8-18/h2-10,17,19H,11-16H2,1H3,(H,24,30)