5-nitro-N-(phenylmethyl)-6-piperidin-1-yl-N-pyridin-2-yl-pyrimidin-4-amine

Systemtic Name: 5-nitro-N-(phenylmethyl)-6-piperidin-1-yl-N-pyridin-2-yl-pyrimidin-4-amine Openeye Name: N-benzyl-5-nitro-6-(1-piperidyl)-N-(2-pyridyl)pyrimidin-4-amine CAS Name: 5-nitro-N-(phenylmethyl)-6-(1-piperidinyl)-N-(2-pyridinyl)-4-pyrimidinamine IUPAC Name: N-benzyl-5-nitro-6-piperidin-1-yl-N-pyridin-2-ylpyrimidin-4-amine Traditional Name: benzyl-(5-nitro-6-piperidino-pyrimidin-4-yl)-(2-pyridyl)amine Formula: C21H22N6O2 MolecularWeight: 390.43838

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C(=NC=N2)N(CC3=CC=CC=C3)C4=CC=CC=N4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=C(C(=NC=N2)N(CC3=CC=CC=C3)C4=CC=CC=N4)[N+](=O)[O-]

InChI

InChI=1S/C21H22N6O2/c28-27(29)19-20(25-13-7-2-8-14-25)23-16-24-21(19)26(18-11-5-6-12-22-18)15-17-9-3-1-4-10-17/h1,3-6,9-12,16H,2,7-8,13-15H2