[2-[[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]amino]-2-oxidanylidene-ethyl] 5-oxidanylidenepyrrolidine-2-carboxylate

Systemtic Name: [2-[[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]amino]-2-oxidanylidene-ethyl] 5-oxidanylidenepyrrolidine-2-carboxylate Openeye Name: [2-[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]-2-oxo-ethyl] 5-oxopyrrolidine-2-carboxylate CAS Name: 5-oxo-2-pyrrolidinecarboxylic acid [2-[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]-2-oxoethyl] ester IUPAC Name: [2-[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]-2-oxoethyl] 5-oxopyrrolidine-2-carboxylate Traditional Name: 5-ketopyrrolidine-2-carboxylic acid [2-keto-2-[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]ethyl] ester Formula: C21H19N3O4S MolecularWeight: 409.45826

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)COC(=O)C4CCC(=O)N4

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)COC(=O)C4CCC(=O)N4

InChI

InChI=1S/C21H19N3O4S/c1-12-2-7-15-17(10-12)29-20(24-15)13-3-5-14(6-4-13)22-19(26)11-28-21(27)16-8-9-18(25)23-16/h2-7,10,16H,8-9,11H2,1H3,(H,22,26)(H,23,25)