6-[4-(3-chlorophenyl)piperazin-1-yl]-5-nitro-N-(phenylmethyl)-N-pyridin-2-yl-pyrimidin-4-amine

Systemtic Name: 6-[4-(3-chlorophenyl)piperazin-1-yl]-5-nitro-N-(phenylmethyl)-N-pyridin-2-yl-pyrimidin-4-amine Openeye Name: N-benzyl-6-[4-(3-chlorophenyl)piperazin-1-yl]-5-nitro-N-(2-pyridyl)pyrimidin-4-amine CAS Name: 6-[4-(3-chlorophenyl)-1-piperazinyl]-5-nitro-N-(phenylmethyl)-N-(2-pyridinyl)-4-pyrimidinamine IUPAC Name: N-benzyl-6-[4-(3-chlorophenyl)piperazin-1-yl]-5-nitro-N-pyridin-2-ylpyrimidin-4-amine Traditional Name: benzyl-[6-[4-(3-chlorophenyl)piperazino]-5-nitro-pyrimidin-4-yl]-(2-pyridyl)amine Formula: C26H24ClN7O2 MolecularWeight: 501.96746

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=CC=C2)Cl)C3=C(C(=NC=N3)N(CC4=CC=CC=C4)C5=CC=CC=N5)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC(=CC=C2)Cl)C3=C(C(=NC=N3)N(CC4=CC=CC=C4)C5=CC=CC=N5)[N+](=O)[O-]

InChI

InChI=1S/C26H24ClN7O2/c27-21-9-6-10-22(17-21)31-13-15-32(16-14-31)25-24(34(35)36)26(30-19-29-25)33(23-11-4-5-12-28-23)18-20-7-2-1-3-8-20/h1-12,17,19H,13-16,18H2