phenacyl 4-(1,3-thiazol-4-ylmethylsulfanyl)benzoate

Systemtic Name: phenacyl 4-(1,3-thiazol-4-ylmethylsulfanyl)benzoate Openeye Name: phenacyl 4-(thiazol-4-ylmethylsulfanyl)benzoate CAS Name: 4-(4-thiazolylmethylthio)benzoic acid phenacyl ester IUPAC Name: phenacyl 4-(1,3-thiazol-4-ylmethylsulfanyl)benzoate Traditional Name: 4-(thiazol-4-ylmethylthio)benzoic acid phenacyl ester Formula: C19H15NO3S2 MolecularWeight: 369.4573

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)COC(=O)C2=CC=C(C=C2)SCC3=CSC=N3

Isomeric SMILES

C1=CC=C(C=C1)C(=O)COC(=O)C2=CC=C(C=C2)SCC3=CSC=N3

InChI

InChI=1S/C19H15NO3S2/c21-18(14-4-2-1-3-5-14)10-23-19(22)15-6-8-17(9-7-15)25-12-16-11-24-13-20-16/h1-9,11,13H,10,12H2