[2-oxidanylidene-2-(3-phenylpropylamino)ethyl] 2-(3-chlorophenyl)-1,3-thiazole-4-carboxylate

Systemtic Name: [2-oxidanylidene-2-(3-phenylpropylamino)ethyl] 2-(3-chlorophenyl)-1,3-thiazole-4-carboxylate Openeye Name: [2-oxo-2-(3-phenylpropylamino)ethyl] 2-(3-chlorophenyl)thiazole-4-carboxylate CAS Name: 2-(3-chlorophenyl)-4-thiazolecarboxylic acid [2-oxo-2-(3-phenylpropylamino)ethyl] ester IUPAC Name: [2-oxo-2-(3-phenylpropylamino)ethyl] 2-(3-chlorophenyl)-1,3-thiazole-4-carboxylate Traditional Name: 2-(3-chlorophenyl)thiazole-4-carboxylic acid [2-keto-2-(3-phenylpropylamino)ethyl] ester Formula: C21H19ClN2O3S MolecularWeight: 414.90516

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCNC(=O)COC(=O)C2=CSC(=N2)C3=CC(=CC=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)CCCNC(=O)COC(=O)C2=CSC(=N2)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C21H19ClN2O3S/c22-17-10-4-9-16(12-17)20-24-18(14-28-20)21(26)27-13-19(25)23-11-5-8-15-6-2-1-3-7-15/h1-4,6-7,9-10,12,14H,5,8,11,13H2,(H,23,25)