5-nitro-N-(phenylmethyl)-6-piperazin-1-yl-pyrimidin-4-amine

Systemtic Name: 5-nitro-N-(phenylmethyl)-6-piperazin-1-yl-pyrimidin-4-amine Openeye Name: N-benzyl-5-nitro-6-piperazin-1-yl-pyrimidin-4-amine CAS Name: 5-nitro-N-(phenylmethyl)-6-(1-piperazinyl)-4-pyrimidinamine IUPAC Name: N-benzyl-5-nitro-6-piperazin-1-ylpyrimidin-4-amine Traditional Name: benzyl-(5-nitro-6-piperazino-pyrimidin-4-yl)amine Formula: C15H18N6O2 MolecularWeight: 314.34242

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=C(C(=NC=N2)NCC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1)C2=C(C(=NC=N2)NCC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H18N6O2/c22-21(23)13-14(17-10-12-4-2-1-3-5-12)18-11-19-15(13)20-8-6-16-7-9-20/h1-5,11,16H,6-10H2,(H,17,18,19)