N-(2-methoxy-5-methyl-phenyl)-6-methyl-2-(4-nitropyrazol-1-yl)pyrimidin-4-amine

Systemtic Name: N-(2-methoxy-5-methyl-phenyl)-6-methyl-2-(4-nitropyrazol-1-yl)pyrimidin-4-amine Openeye Name: N-(2-methoxy-5-methyl-phenyl)-6-methyl-2-(4-nitropyrazol-1-yl)pyrimidin-4-amine CAS Name: N-(2-methoxy-5-methylphenyl)-6-methyl-2-(4-nitro-1-pyrazolyl)-4-pyrimidinamine IUPAC Name: N-(2-methoxy-5-methylphenyl)-6-methyl-2-(4-nitropyrazol-1-yl)pyrimidin-4-amine Traditional Name: (2-methoxy-5-methyl-phenyl)-[6-methyl-2-(4-nitropyrazol-1-yl)pyrimidin-4-yl]amine Formula: C16H16N6O3 MolecularWeight: 340.33664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC2=NC(=NC(=C2)C)N3C=C(C=N3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC2=NC(=NC(=C2)C)N3C=C(C=N3)[N+](=O)[O-]

InChI

InChI=1S/C16H16N6O3/c1-10-4-5-14(25-3)13(6-10)19-15-7-11(2)18-16(20-15)21-9-12(8-17-21)22(23)24/h4-9H,1-3H3,(H,18,19,20)