[2-[(3-chlorophenyl)amino]-2-oxidanylidene-ethyl] 1-(6-methoxy-1,3-benzothiazol-2-yl)-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: [2-[(3-chlorophenyl)amino]-2-oxidanylidene-ethyl] 1-(6-methoxy-1,3-benzothiazol-2-yl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: [2-(3-chloroanilino)-2-oxo-ethyl] 1-(6-methoxy-1,3-benzothiazol-2-yl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: 1-(6-methoxy-1,3-benzothiazol-2-yl)-5-oxo-3-pyrrolidinecarboxylic acid [2-(3-chloroanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-chloroanilino)-2-oxoethyl] 1-(6-methoxy-1,3-benzothiazol-2-yl)-5-oxopyrrolidine-3-carboxylate Traditional Name: 5-keto-1-(6-methoxy-1,3-benzothiazol-2-yl)pyrrolidine-3-carboxylic acid [2-(3-chloroanilino)-2-keto-ethyl] ester Formula: C21H18ClN3O5S MolecularWeight: 459.90272

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(S2)N3CC(CC3=O)C(=O)OCC(=O)NC4=CC(=CC=C4)Cl

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(S2)N3CC(CC3=O)C(=O)OCC(=O)NC4=CC(=CC=C4)Cl

InChI

InChI=1S/C21H18ClN3O5S/c1-29-15-5-6-16-17(9-15)31-21(24-16)25-10-12(7-19(25)27)20(28)30-11-18(26)23-14-4-2-3-13(22)8-14/h2-6,8-9,12H,7,10-11H2,1H3,(H,23,26)