methyl 3-[1-[(2-methylsulfanylphenyl)carbamothioyl]piperidin-4-yl]-2-oxidanylidene-1,3-oxazolidine-4-carboxylate

Systemtic Name: methyl 3-[1-[(2-methylsulfanylphenyl)carbamothioyl]piperidin-4-yl]-2-oxidanylidene-1,3-oxazolidine-4-carboxylate Openeye Name: methyl 3-[1-[(2-methylsulfanylphenyl)carbamothioyl]-4-piperidyl]-2-oxo-oxazolidine-4-carboxylate CAS Name: 3-[1-[[2-(methylthio)anilino]-sulfanylidenemethyl]-4-piperidinyl]-2-oxo-4-oxazolidinecarboxylic acid methyl ester IUPAC Name: methyl 3-[1-[(2-methylsulfanylphenyl)carbamothioyl]piperidin-4-yl]-2-oxo-1,3-oxazolidine-4-carboxylate Traditional Name: 2-keto-3-[1-[[2-(methylthio)phenyl]thiocarbamoyl]-4-piperidyl]oxazolidine-4-carboxylic acid methyl ester Formula: C18H23N3O4S2 MolecularWeight: 409.52292

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1COC(=O)N1C2CCN(CC2)C(=S)NC3=CC=CC=C3SC

Isomeric SMILES

COC(=O)C1COC(=O)N1C2CCN(CC2)C(=S)NC3=CC=CC=C3SC

InChI

InChI=1S/C18H23N3O4S2/c1-24-16(22)14-11-25-18(23)21(14)12-7-9-20(10-8-12)17(26)19-13-5-3-4-6-15(13)27-2/h3-6,12,14H,7-11H2,1-2H3,(H,19,26)