3-[4-[(E)-[(6-azanyl-5-nitro-pyrimidin-4-yl)hydrazinylidene]methyl]-3-methyl-pyrazol-1-yl]propanenitrile

Systemtic Name: 3-[4-[(E)-[(6-azanyl-5-nitro-pyrimidin-4-yl)hydrazinylidene]methyl]-3-methyl-pyrazol-1-yl]propanenitrile Openeye Name: 3-[4-[(E)-[(6-amino-5-nitro-pyrimidin-4-yl)hydrazono]methyl]-3-methyl-pyrazol-1-yl]propanenitrile CAS Name: 3-[4-[(E)-[(6-amino-5-nitro-4-pyrimidinyl)hydrazinylidene]methyl]-3-methyl-1-pyrazolyl]propanenitrile IUPAC Name: 3-[4-[(E)-[(6-amino-5-nitropyrimidin-4-yl)hydrazinylidene]methyl]-3-methylpyrazol-1-yl]propanenitrile Traditional Name: 3-[4-[(E)-[(6-amino-5-nitro-pyrimidin-4-yl)hydrazono]methyl]-3-methyl-pyrazol-1-yl]propionitrile Formula: C12H13N9O2 MolecularWeight: 315.29072

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1C=NNC2=NC=NC(=C2[N+](=O)[O-])N)CCC#N

Isomeric SMILES

CC1=NN(C=C1/C=N/NC2=NC=NC(=C2[N+](=O)[O-])N)CCC#N

InChI

InChI=1S/C12H13N9O2/c1-8-9(6-20(19-8)4-2-3-13)5-17-18-12-10(21(22)23)11(14)15-7-16-12/h5-7H,2,4H2,1H3,(H3,14,15,16,18)/b17-5+