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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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