ethyl 3-(1,3-benzothiazol-2-ylmethyl)-1-ethyl-2-oxidanylidene-benzimidazole-5-carboxylate

Systemtic Name: ethyl 3-(1,3-benzothiazol-2-ylmethyl)-1-ethyl-2-oxidanylidene-benzimidazole-5-carboxylate Openeye Name: ethyl 3-(1,3-benzothiazol-2-ylmethyl)-1-ethyl-2-oxo-benzimidazole-5-carboxylate CAS Name: 3-(1,3-benzothiazol-2-ylmethyl)-1-ethyl-2-oxo-5-benzimidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-(1,3-benzothiazol-2-ylmethyl)-1-ethyl-2-oxobenzimidazole-5-carboxylate Traditional Name: 3-(1,3-benzothiazol-2-ylmethyl)-1-ethyl-2-keto-benzimidazole-5-carboxylic acid ethyl ester Formula: C20H19N3O3S MolecularWeight: 381.44816

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)OCC)N(C1=O)CC3=NC4=CC=CC=C4S3

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)OCC)N(C1=O)CC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H19N3O3S/c1-3-22-15-10-9-13(19(24)26-4-2)11-16(15)23(20(22)25)12-18-21-14-7-5-6-8-17(14)27-18/h5-11H,3-4,12H2,1-2H3