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

Systemtic Name: ethyl 3-(2-ethoxyethyl)-2-naphthalen-2-ylcarbonylimino-1,3-benzothiazole-6-carboxylate Openeye Name: ethyl 3-(2-ethoxyethyl)-2-(naphthalene-2-carbonylimino)-1,3-benzothiazole-6-carboxylate CAS Name: 3-(2-ethoxyethyl)-2-[2-naphthalenyl(oxo)methyl]imino-1,3-benzothiazole-6-carboxylic acid ethyl ester IUPAC Name: ethyl 3-(2-ethoxyethyl)-2-(naphthalene-2-carbonylimino)-1,3-benzothiazole-6-carboxylate Traditional Name: 3-(2-ethoxyethyl)-2-(2-naphthoylimino)-1,3-benzothiazole-6-carboxylic acid ethyl ester Formula: C25H24N2O4S MolecularWeight: 448.53406

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCN1C2=C(C=C(C=C2)C(=O)OCC)SC1=NC(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CCOCCN1C2=C(C=C(C=C2)C(=O)OCC)SC1=NC(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C25H24N2O4S/c1-3-30-14-13-27-21-12-11-20(24(29)31-4-2)16-22(21)32-25(27)26-23(28)19-10-9-17-7-5-6-8-18(17)15-19/h5-12,15-16H,3-4,13-14H2,1-2H3