ethyl 2-[4-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]phenyl]carbonylimino-3-ethyl-1,3-benzothiazole-6-carboxylate

Systemtic Name: ethyl 2-[4-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]phenyl]carbonylimino-3-ethyl-1,3-benzothiazole-6-carboxylate Openeye Name: ethyl 2-[4-(2,5-dioxopyrrolidin-1-yl)benzoyl]imino-3-ethyl-1,3-benzothiazole-6-carboxylate CAS Name: 2-[[4-(2,5-dioxo-1-pyrrolidinyl)phenyl]-oxomethyl]imino-3-ethyl-1,3-benzothiazole-6-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[4-(2,5-dioxopyrrolidin-1-yl)benzoyl]imino-3-ethyl-1,3-benzothiazole-6-carboxylate Traditional Name: 3-ethyl-2-(4-succinimidobenzoyl)imino-1,3-benzothiazole-6-carboxylic acid ethyl ester Formula: C23H21N3O5S MolecularWeight: 451.49494

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)OCC)SC1=NC(=O)C3=CC=C(C=C3)N4C(=O)CCC4=O

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)OCC)SC1=NC(=O)C3=CC=C(C=C3)N4C(=O)CCC4=O

InChI

InChI=1S/C23H21N3O5S/c1-3-25-17-10-7-15(22(30)31-4-2)13-18(17)32-23(25)24-21(29)14-5-8-16(9-6-14)26-19(27)11-12-20(26)28/h5-10,13H,3-4,11-12H2,1-2H3