methyl 2-(phenylmethylsulfanyl)-4,5-dihydro-1,3-thiazole-4-carboxylate

Systemtic Name: methyl 2-(phenylmethylsulfanyl)-4,5-dihydro-1,3-thiazole-4-carboxylate Openeye Name: methyl 2-benzylsulfanyl-4,5-dihydrothiazole-4-carboxylate CAS Name: 2-(phenylmethylthio)-4,5-dihydrothiazole-4-carboxylic acid methyl ester IUPAC Name: methyl 2-benzylsulfanyl-4,5-dihydro-1,3-thiazole-4-carboxylate Traditional Name: 2-(benzylthio)-2-thiazoline-4-carboxylic acid methyl ester Formula: C12H13NO2S2 MolecularWeight: 267.36712

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CSC(=N1)SCC2=CC=CC=C2

Isomeric SMILES

COC(=O)C1CSC(=N1)SCC2=CC=CC=C2

InChI

InChI=1S/C12H13NO2S2/c1-15-11(14)10-8-17-12(13-10)16-7-9-5-3-2-4-6-9/h2-6,10H,7-8H2,1H3