methyl 4-[(4-phenyl-1,3-thiazol-2-yl)sulfanylmethyl]benzoate

Systemtic Name: methyl 4-[(4-phenyl-1,3-thiazol-2-yl)sulfanylmethyl]benzoate Openeye Name: methyl 4-[(4-phenylthiazol-2-yl)sulfanylmethyl]benzoate CAS Name: 4-[[(4-phenyl-2-thiazolyl)thio]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(4-phenyl-1,3-thiazol-2-yl)sulfanylmethyl]benzoate Traditional Name: 4-[[(4-phenylthiazol-2-yl)thio]methyl]benzoic acid methyl ester Formula: C18H15NO2S2 MolecularWeight: 341.4472

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CSC2=NC(=CS2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CSC2=NC(=CS2)C3=CC=CC=C3

InChI

InChI=1S/C18H15NO2S2/c1-21-17(20)15-9-7-13(8-10-15)11-22-18-19-16(12-23-18)14-5-3-2-4-6-14/h2-10,12H,11H2,1H3