ethyl 4-(4-chlorophenyl)-5-ethanoylimino-1,3,4-thiadiazole-2-carboxylate

Systemtic Name: ethyl 4-(4-chlorophenyl)-5-ethanoylimino-1,3,4-thiadiazole-2-carboxylate Openeye Name: ethyl 5-acetylimino-4-(4-chlorophenyl)-1,3,4-thiadiazole-2-carboxylate CAS Name: 5-acetylimino-4-(4-chlorophenyl)-1,3,4-thiadiazole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 5-acetylimino-4-(4-chlorophenyl)-1,3,4-thiadiazole-2-carboxylate Traditional Name: 5-acetylimino-4-(4-chlorophenyl)-1,3,4-thiadiazole-2-carboxylic acid ethyl ester Formula: C13H12ClN3O3S MolecularWeight: 325.77068

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=NC(=O)C)S1)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCOC(=O)C1=NN(C(=NC(=O)C)S1)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C13H12ClN3O3S/c1-3-20-12(19)11-16-17(13(21-11)15-8(2)18)10-6-4-9(14)5-7-10/h4-7H,3H2,1-2H3