1,3-benzothiazol-2-ylmethyl 2-(2-chlorophenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 2-(2-chlorophenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: 1,3-benzothiazol-2-ylmethyl 2-(2-chlorophenyl)-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 2-(2-chlorophenyl)-1,3-dioxo-5-isoindolecarboxylic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 2-(2-chlorophenyl)-1,3-dioxoisoindole-5-carboxylate Traditional Name: 2-(2-chlorophenyl)-1,3-diketo-isoindoline-5-carboxylic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C23H13ClN2O4S MolecularWeight: 448.87832

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)COC(=O)C3=CC4=C(C=C3)C(=O)N(C4=O)C5=CC=CC=C5Cl

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)COC(=O)C3=CC4=C(C=C3)C(=O)N(C4=O)C5=CC=CC=C5Cl

InChI

InChI=1S/C23H13ClN2O4S/c24-16-5-1-3-7-18(16)26-21(27)14-10-9-13(11-15(14)22(26)28)23(29)30-12-20-25-17-6-2-4-8-19(17)31-20/h1-11H,12H2