[2-[(2-chlorophenyl)methylamino]-2-oxidanylidene-ethyl] 2-(1,3-thiazol-4-ylmethylsulfanyl)benzoate

Systemtic Name: [2-[(2-chlorophenyl)methylamino]-2-oxidanylidene-ethyl] 2-(1,3-thiazol-4-ylmethylsulfanyl)benzoate Openeye Name: [2-[(2-chlorophenyl)methylamino]-2-oxo-ethyl] 2-(thiazol-4-ylmethylsulfanyl)benzoate CAS Name: 2-(4-thiazolylmethylthio)benzoic acid [2-[(2-chlorophenyl)methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(2-chlorophenyl)methylamino]-2-oxoethyl] 2-(1,3-thiazol-4-ylmethylsulfanyl)benzoate Traditional Name: 2-(thiazol-4-ylmethylthio)benzoic acid [2-[(2-chlorobenzyl)amino]-2-keto-ethyl] ester Formula: C20H17ClN2O3S2 MolecularWeight: 432.94358

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CNC(=O)COC(=O)C2=CC=CC=C2SCC3=CSC=N3)Cl

Isomeric SMILES

C1=CC=C(C(=C1)CNC(=O)COC(=O)C2=CC=CC=C2SCC3=CSC=N3)Cl

InChI

InChI=1S/C20H17ClN2O3S2/c21-17-7-3-1-5-14(17)9-22-19(24)10-26-20(25)16-6-2-4-8-18(16)28-12-15-11-27-13-23-15/h1-8,11,13H,9-10,12H2,(H,22,24)