propan-2-yl 4-[[4-(1,3-thiazol-4-ylmethylsulfanyl)phenyl]carbonylamino]benzoate

Systemtic Name: propan-2-yl 4-[[4-(1,3-thiazol-4-ylmethylsulfanyl)phenyl]carbonylamino]benzoate Openeye Name: isopropyl 4-[[4-(thiazol-4-ylmethylsulfanyl)benzoyl]amino]benzoate CAS Name: 4-[[oxo-[4-(4-thiazolylmethylthio)phenyl]methyl]amino]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[[4-(1,3-thiazol-4-ylmethylsulfanyl)benzoyl]amino]benzoate Traditional Name: 4-[[4-(thiazol-4-ylmethylthio)benzoyl]amino]benzoic acid isopropyl ester Formula: C21H20N2O3S2 MolecularWeight: 412.5251

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)SCC3=CSC=N3

Isomeric SMILES

CC(C)OC(=O)C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)SCC3=CSC=N3

InChI

InChI=1S/C21H20N2O3S2/c1-14(2)26-21(25)16-3-7-17(8-4-16)23-20(24)15-5-9-19(10-6-15)28-12-18-11-27-13-22-18/h3-11,13-14H,12H2,1-2H3,(H,23,24)