methyl 4-(4,5-dihydro-1,3-thiazol-2-ylsulfanylmethyl)benzoate

Systemtic Name: methyl 4-(4,5-dihydro-1,3-thiazol-2-ylsulfanylmethyl)benzoate Openeye Name: methyl 4-(4,5-dihydrothiazol-2-ylsulfanylmethyl)benzoate CAS Name: 4-[(4,5-dihydrothiazol-2-ylthio)methyl]benzoic acid methyl ester IUPAC Name: methyl 4-(4,5-dihydro-1,3-thiazol-2-ylsulfanylmethyl)benzoate Traditional Name: 4-[(2-thiazolin-2-ylthio)methyl]benzoic acid methyl ester Formula: C12H13NO2S2 MolecularWeight: 267.36712

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CSC2=NCCS2

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CSC2=NCCS2

InChI

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