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

Systemtic Name: 5-nitro-N4-[(E)-(1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)methylideneamino]pyrimidine-4,6-diamine Openeye Name: 5-nitro-N4-[(E)-[1-phenyl-3-(3-pyridyl)pyrazol-4-yl]methyleneamino]pyrimidine-4,6-diamine CAS Name: 5-nitro-N4-[(E)-[1-phenyl-3-(3-pyridinyl)-4-pyrazolyl]methylideneamino]pyrimidine-4,6-diamine IUPAC Name: 5-nitro-4-N-[(E)-(1-phenyl-3-pyridin-3-ylpyrazol-4-yl)methylideneamino]pyrimidine-4,6-diamine Traditional Name: (6-amino-5-nitro-pyrimidin-4-yl)-[(E)-[1-phenyl-3-(3-pyridyl)pyrazol-4-yl]methyleneamino]amine Formula: C19H15N9O2 MolecularWeight: 401.3815

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CN=CC=C3)C=NNC4=NC=NC(=C4[N+](=O)[O-])N

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CN=CC=C3)/C=N/NC4=NC=NC(=C4[N+](=O)[O-])N

InChI

InChI=1S/C19H15N9O2/c20-18-17(28(29)30)19(23-12-22-18)25-24-10-14-11-27(15-6-2-1-3-7-15)26-16(14)13-5-4-8-21-9-13/h1-12H,(H3,20,22,23,25)/b24-10+