5-nitro-N-[1-(phenylmethyl)piperidin-4-yl]-6-piperidin-1-yl-pyrimidin-4-amine

Systemtic Name: 5-nitro-N-[1-(phenylmethyl)piperidin-4-yl]-6-piperidin-1-yl-pyrimidin-4-amine Openeye Name: N-(1-benzyl-4-piperidyl)-5-nitro-6-(1-piperidyl)pyrimidin-4-amine CAS Name: 5-nitro-N-[1-(phenylmethyl)-4-piperidinyl]-6-(1-piperidinyl)-4-pyrimidinamine IUPAC Name: N-(1-benzylpiperidin-4-yl)-5-nitro-6-piperidin-1-ylpyrimidin-4-amine Traditional Name: (1-benzyl-4-piperidyl)-(5-nitro-6-piperidino-pyrimidin-4-yl)amine Formula: C21H28N6O2 MolecularWeight: 396.48602

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C(=NC=N2)NC3CCN(CC3)CC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=C(C(=NC=N2)NC3CCN(CC3)CC4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H28N6O2/c28-27(29)19-20(22-16-23-21(19)26-11-5-2-6-12-26)24-18-9-13-25(14-10-18)15-17-7-3-1-4-8-17/h1,3-4,7-8,16,18H,2,5-6,9-15H2,(H,22,23,24)