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

Systemtic Name: [2-[(3,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl] 1-(6-methoxy-1,3-benzothiazol-2-yl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: [2-(3,5-dimethylanilino)-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-(3,5-dimethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(3,5-dimethylanilino)-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-(3,5-dimethylanilino)-2-keto-ethyl] ester Formula: C23H23N3O5S MolecularWeight: 453.51082

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)COC(=O)C2CC(=O)N(C2)C3=NC4=C(S3)C=C(C=C4)OC)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)COC(=O)C2CC(=O)N(C2)C3=NC4=C(S3)C=C(C=C4)OC)C

InChI

InChI=1S/C23H23N3O5S/c1-13-6-14(2)8-16(7-13)24-20(27)12-31-22(29)15-9-21(28)26(11-15)23-25-18-5-4-17(30-3)10-19(18)32-23/h4-8,10,15H,9,11-12H2,1-3H3,(H,24,27)