N-[(4-methylphenyl)methyl]-5-nitro-6-pyridin-3-yloxy-pyrimidin-4-amine

Systemtic Name: N-[(4-methylphenyl)methyl]-5-nitro-6-pyridin-3-yloxy-pyrimidin-4-amine Openeye Name: 5-nitro-N-(p-tolylmethyl)-6-(3-pyridyloxy)pyrimidin-4-amine CAS Name: N-[(4-methylphenyl)methyl]-5-nitro-6-(3-pyridinyloxy)-4-pyrimidinamine IUPAC Name: N-[(4-methylphenyl)methyl]-5-nitro-6-pyridin-3-yloxypyrimidin-4-amine Traditional Name: (4-methylbenzyl)-[5-nitro-6-(3-pyridyloxy)pyrimidin-4-yl]amine Formula: C17H15N5O3 MolecularWeight: 337.3327

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC2=C(C(=NC=N2)OC3=CN=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)CNC2=C(C(=NC=N2)OC3=CN=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H15N5O3/c1-12-4-6-13(7-5-12)9-19-16-15(22(23)24)17(21-11-20-16)25-14-3-2-8-18-10-14/h2-8,10-11H,9H2,1H3,(H,19,20,21)