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

Systemtic Name: methyl 5-(phenylmethylsulfanyl)-1,3-thiazole-4-carboxylate Openeye Name: methyl 5-benzylsulfanylthiazole-4-carboxylate CAS Name: 5-(phenylmethylthio)-4-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 5-benzylsulfanyl-1,3-thiazole-4-carboxylate Traditional Name: 5-(benzylthio)thiazole-4-carboxylic acid methyl ester Formula: C12H11NO2S2 MolecularWeight: 265.35124

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC=N1)SCC2=CC=CC=C2

Isomeric SMILES

COC(=O)C1=C(SC=N1)SCC2=CC=CC=C2

InChI

InChI=1S/C12H11NO2S2/c1-15-11(14)10-12(17-8-13-10)16-7-9-5-3-2-4-6-9/h2-6,8H,7H2,1H3