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

Systemtic Name: ethyl 5-azanylidene-4-(3-nitrophenyl)-1,3,4-thiadiazole-2-carboxylate Openeye Name: ethyl 5-imino-4-(3-nitrophenyl)-1,3,4-thiadiazole-2-carboxylate CAS Name: 5-imino-4-(3-nitrophenyl)-1,3,4-thiadiazole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 5-imino-4-(3-nitrophenyl)-1,3,4-thiadiazole-2-carboxylate Traditional Name: 5-imino-4-(3-nitrophenyl)-1,3,4-thiadiazole-2-carboxylic acid ethyl ester Formula: C11H10N4O4S MolecularWeight: 294.2865

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=N)S1)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=NN(C(=N)S1)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C11H10N4O4S/c1-2-19-10(16)9-13-14(11(12)20-9)7-4-3-5-8(6-7)15(17)18/h3-6,12H,2H2,1H3