ethyl 3-(2-ethoxyethyl)-2-(phenylcarbonylimino)-1,3-benzothiazole-6-carboxylate

Systemtic Name: ethyl 3-(2-ethoxyethyl)-2-(phenylcarbonylimino)-1,3-benzothiazole-6-carboxylate Openeye Name: ethyl 2-benzoylimino-3-(2-ethoxyethyl)-1,3-benzothiazole-6-carboxylate CAS Name: 2-benzoylimino-3-(2-ethoxyethyl)-1,3-benzothiazole-6-carboxylic acid ethyl ester IUPAC Name: ethyl 2-benzoylimino-3-(2-ethoxyethyl)-1,3-benzothiazole-6-carboxylate Traditional Name: 2-benzoylimino-3-(2-ethoxyethyl)-1,3-benzothiazole-6-carboxylic acid ethyl ester Formula: C21H22N2O4S MolecularWeight: 398.47538

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCN1C2=C(C=C(C=C2)C(=O)OCC)SC1=NC(=O)C3=CC=CC=C3

Isomeric SMILES

CCOCCN1C2=C(C=C(C=C2)C(=O)OCC)SC1=NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H22N2O4S/c1-3-26-13-12-23-17-11-10-16(20(25)27-4-2)14-18(17)28-21(23)22-19(24)15-8-6-5-7-9-15/h5-11,14H,3-4,12-13H2,1-2H3