ethyl 2-(1,5-dimethylpyrazol-3-yl)carbonylimino-3-(2-ethoxyethyl)-1,3-benzothiazole-6-carboxylate

Systemtic Name: ethyl 2-(1,5-dimethylpyrazol-3-yl)carbonylimino-3-(2-ethoxyethyl)-1,3-benzothiazole-6-carboxylate Openeye Name: ethyl 2-(1,5-dimethylpyrazole-3-carbonyl)imino-3-(2-ethoxyethyl)-1,3-benzothiazole-6-carboxylate CAS Name: 2-[(1,5-dimethyl-3-pyrazolyl)-oxomethyl]imino-3-(2-ethoxyethyl)-1,3-benzothiazole-6-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(1,5-dimethylpyrazole-3-carbonyl)imino-3-(2-ethoxyethyl)-1,3-benzothiazole-6-carboxylate Traditional Name: 2-(1,5-dimethylpyrazole-3-carbonyl)imino-3-(2-ethoxyethyl)-1,3-benzothiazole-6-carboxylic acid ethyl ester Formula: C20H24N4O4S MolecularWeight: 416.49396

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24N4O4S/c1-5-27-10-9-24-16-8-7-14(19(26)28-6-2)12-17(16)29-20(24)21-18(25)15-11-13(3)23(4)22-15/h7-8,11-12H,5-6,9-10H2,1-4H3