[2-(4-chlorophenyl)-1,3-thiazol-4-yl]methyl 3-cyanobenzoate

Systemtic Name: [2-(4-chlorophenyl)-1,3-thiazol-4-yl]methyl 3-cyanobenzoate Openeye Name: [2-(4-chlorophenyl)thiazol-4-yl]methyl 3-cyanobenzoate CAS Name: 3-cyanobenzoic acid [2-(4-chlorophenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(4-chlorophenyl)-1,3-thiazol-4-yl]methyl 3-cyanobenzoate Traditional Name: 3-cyanobenzoic acid [2-(4-chlorophenyl)thiazol-4-yl]methyl ester Formula: C18H11ClN2O2S MolecularWeight: 354.81014

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(=O)OCC2=CSC(=N2)C3=CC=C(C=C3)Cl)C#N

Isomeric SMILES

C1=CC(=CC(=C1)C(=O)OCC2=CSC(=N2)C3=CC=C(C=C3)Cl)C#N

InChI

InChI=1S/C18H11ClN2O2S/c19-15-6-4-13(5-7-15)17-21-16(11-24-17)10-23-18(22)14-3-1-2-12(8-14)9-20/h1-8,11H,10H2