4-(3-methyl-1-phenyl-pyrazol-4-yl)-N-(3-nitrophenyl)pyrimidin-2-amine

Systemtic Name: 4-(3-methyl-1-phenyl-pyrazol-4-yl)-N-(3-nitrophenyl)pyrimidin-2-amine Openeye Name: 4-(3-methyl-1-phenyl-pyrazol-4-yl)-N-(3-nitrophenyl)pyrimidin-2-amine CAS Name: 4-(3-methyl-1-phenyl-4-pyrazolyl)-N-(3-nitrophenyl)-2-pyrimidinamine IUPAC Name: 4-(3-methyl-1-phenylpyrazol-4-yl)-N-(3-nitrophenyl)pyrimidin-2-amine Traditional Name: [4-(3-methyl-1-phenyl-pyrazol-4-yl)pyrimidin-2-yl]-(3-nitrophenyl)amine Formula: C20H16N6O2 MolecularWeight: 372.38004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1C2=NC(=NC=C2)NC3=CC(=CC=C3)[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C=C1C2=NC(=NC=C2)NC3=CC(=CC=C3)[N+](=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C20H16N6O2/c1-14-18(13-25(24-14)16-7-3-2-4-8-16)19-10-11-21-20(23-19)22-15-6-5-9-17(12-15)26(27)28/h2-13H,1H3,(H,21,22,23)