methyl 2-[(2Z)-2-[4-azanyl-2-(cyanoamino)-6-oxidanylidene-pyrimidin-5-ylidene]hydrazinyl]benzoate

Systemtic Name: methyl 2-[(2Z)-2-[4-azanyl-2-(cyanoamino)-6-oxidanylidene-pyrimidin-5-ylidene]hydrazinyl]benzoate Openeye Name: methyl 2-[(2Z)-2-[4-amino-2-(cyanoamino)-6-oxo-pyrimidin-5-ylidene]hydrazino]benzoate CAS Name: 2-[(2Z)-2-[4-amino-2-(cyanoamino)-6-oxo-5-pyrimidinylidene]hydrazinyl]benzoic acid methyl ester IUPAC Name: methyl 2-[(2Z)-2-[4-amino-2-(cyanoamino)-6-oxopyrimidin-5-ylidene]hydrazinyl]benzoate Traditional Name: 2-[(N'Z)-N'-[4-amino-2-(cyanoamino)-6-keto-pyrimidin-5-ylidene]hydrazino]benzoic acid methyl ester Formula: C13H11N7O3 MolecularWeight: 313.27154

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NN=C2C(=NC(=NC2=O)NC#N)N

Isomeric SMILES

COC(=O)C1=CC=CC=C1N/N=C\2/C(=NC(=NC2=O)NC#N)N

InChI

InChI=1S/C13H11N7O3/c1-23-12(22)7-4-2-3-5-8(7)19-20-9-10(15)17-13(16-6-14)18-11(9)21/h2-5,19H,1H3,(H3,15,16,17,18,21)/b20-9-