2-(4-ethylpiperazin-1-yl)-5-nitro-N-(phenylmethyl)pyrimidin-4-amine

Systemtic Name: 2-(4-ethylpiperazin-1-yl)-5-nitro-N-(phenylmethyl)pyrimidin-4-amine Openeye Name: N-benzyl-2-(4-ethylpiperazin-1-yl)-5-nitro-pyrimidin-4-amine CAS Name: 2-(4-ethyl-1-piperazinyl)-5-nitro-N-(phenylmethyl)-4-pyrimidinamine IUPAC Name: N-benzyl-2-(4-ethylpiperazin-1-yl)-5-nitropyrimidin-4-amine Traditional Name: benzyl-[2-(4-ethylpiperazino)-5-nitro-pyrimidin-4-yl]amine Formula: C17H22N6O2 MolecularWeight: 342.39558

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=NC=C(C(=N2)NCC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCN1CCN(CC1)C2=NC=C(C(=N2)NCC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H22N6O2/c1-2-21-8-10-22(11-9-21)17-19-13-15(23(24)25)16(20-17)18-12-14-6-4-3-5-7-14/h3-7,13H,2,8-12H2,1H3,(H,18,19,20)