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

Systemtic Name: 5-nitro-N-(phenylmethyl)-N-pyridin-2-yl-6-pyrrolidin-1-yl-pyrimidin-4-amine Openeye Name: N-benzyl-5-nitro-N-(2-pyridyl)-6-pyrrolidin-1-yl-pyrimidin-4-amine CAS Name: 5-nitro-N-(phenylmethyl)-N-(2-pyridinyl)-6-(1-pyrrolidinyl)-4-pyrimidinamine IUPAC Name: N-benzyl-5-nitro-N-pyridin-2-yl-6-pyrrolidin-1-ylpyrimidin-4-amine Traditional Name: benzyl-(5-nitro-6-pyrrolidino-pyrimidin-4-yl)-(2-pyridyl)amine Formula: C20H20N6O2 MolecularWeight: 376.4118

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C(=NC=N2)N(CC3=CC=CC=C3)C4=CC=CC=N4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=C(C(=NC=N2)N(CC3=CC=CC=C3)C4=CC=CC=N4)[N+](=O)[O-]

InChI

InChI=1S/C20H20N6O2/c27-26(28)18-19(24-12-6-7-13-24)22-15-23-20(18)25(17-10-4-5-11-21-17)14-16-8-2-1-3-9-16/h1-5,8-11,15H,6-7,12-14H2