(4-aminocarbonylphenyl)methyl 4-(1,3-thiazol-4-ylmethylsulfanyl)benzoate

Systemtic Name: (4-aminocarbonylphenyl)methyl 4-(1,3-thiazol-4-ylmethylsulfanyl)benzoate Openeye Name: (4-carbamoylphenyl)methyl 4-(thiazol-4-ylmethylsulfanyl)benzoate CAS Name: 4-(4-thiazolylmethylthio)benzoic acid (4-carbamoylphenyl)methyl ester IUPAC Name: (4-carbamoylphenyl)methyl 4-(1,3-thiazol-4-ylmethylsulfanyl)benzoate Traditional Name: 4-(thiazol-4-ylmethylthio)benzoic acid (4-carbamoylbenzyl) ester Formula: C19H16N2O3S2 MolecularWeight: 384.47194

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1COC(=O)C2=CC=C(C=C2)SCC3=CSC=N3)C(=O)N

Isomeric SMILES

C1=CC(=CC=C1COC(=O)C2=CC=C(C=C2)SCC3=CSC=N3)C(=O)N

InChI

InChI=1S/C19H16N2O3S2/c20-18(22)14-3-1-13(2-4-14)9-24-19(23)15-5-7-17(8-6-15)26-11-16-10-25-12-21-16/h1-8,10,12H,9,11H2,(H2,20,22)