ethyl 1-(4-methylphenyl)-4-[(5-nitro-1,3-thiazol-2-yl)amino]-6-oxidanylidene-pyridazine-3-carboxylate

Systemtic Name: ethyl 1-(4-methylphenyl)-4-[(5-nitro-1,3-thiazol-2-yl)amino]-6-oxidanylidene-pyridazine-3-carboxylate Openeye Name: ethyl 4-[(5-nitrothiazol-2-yl)amino]-6-oxo-1-(p-tolyl)pyridazine-3-carboxylate CAS Name: 1-(4-methylphenyl)-4-[(5-nitro-2-thiazolyl)amino]-6-oxo-3-pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-methylphenyl)-4-[(5-nitro-1,3-thiazol-2-yl)amino]-6-oxopyridazine-3-carboxylate Traditional Name: 6-keto-4-[(5-nitrothiazol-2-yl)amino]-1-(p-tolyl)pyridazine-3-carboxylic acid ethyl ester Formula: C17H15N5O5S MolecularWeight: 401.3965

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=O)C=C1NC2=NC=C(S2)[N+](=O)[O-])C3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)C1=NN(C(=O)C=C1NC2=NC=C(S2)[N+](=O)[O-])C3=CC=C(C=C3)C

InChI

InChI=1S/C17H15N5O5S/c1-3-27-16(24)15-12(19-17-18-9-14(28-17)22(25)26)8-13(23)21(20-15)11-6-4-10(2)5-7-11/h4-9H,3H2,1-2H3,(H,18,19)