N4-[(E)-(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methylideneamino]-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N4-[(E)-(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methylideneamino]-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4-[(E)-(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methyleneamino]-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-[(E)-(5-chloro-3-methyl-1-phenyl-4-pyrazolyl)methylideneamino]-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N-[(E)-(5-chloro-3-methyl-1-phenylpyrazol-4-yl)methylideneamino]-5-nitropyrimidine-4,6-diamine Traditional Name: (6-amino-5-nitro-pyrimidin-4-yl)-[(E)-(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methyleneamino]amine Formula: C15H13ClN8O2 MolecularWeight: 372.76912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=NNC2=NC=NC(=C2[N+](=O)[O-])N)Cl)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1/C=N/NC2=NC=NC(=C2[N+](=O)[O-])N)Cl)C3=CC=CC=C3

InChI

InChI=1S/C15H13ClN8O2/c1-9-11(13(16)23(22-9)10-5-3-2-4-6-10)7-20-21-15-12(24(25)26)14(17)18-8-19-15/h2-8H,1H3,(H3,17,18,19,21)/b20-7+