ethyl 5-azanylidene-4-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxylate

Systemtic Name: ethyl 5-azanylidene-4-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxylate Openeye Name: ethyl 5-imino-4-(p-tolyl)-1,3,4-thiadiazole-2-carboxylate CAS Name: 5-imino-4-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 5-imino-4-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxylate Traditional Name: 5-imino-4-(p-tolyl)-1,3,4-thiadiazole-2-carboxylic acid ethyl ester Formula: C12H13N3O2S MolecularWeight: 263.31552

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=N)S1)C2=CC=C(C=C2)C

Isomeric SMILES

CCOC(=O)C1=NN(C(=N)S1)C2=CC=C(C=C2)C

InChI

InChI=1S/C12H13N3O2S/c1-3-17-11(16)10-14-15(12(13)18-10)9-6-4-8(2)5-7-9/h4-7,13H,3H2,1-2H3