1,1-dimethyl-2-[5-nitro-6-[4-(phenylmethyl)piperazin-1-yl]pyrimidin-4-yl]diazane

Systemtic Name: 1,1-dimethyl-2-[5-nitro-6-[4-(phenylmethyl)piperazin-1-yl]pyrimidin-4-yl]diazane Openeye Name: 2-[6-(4-benzylpiperazin-1-yl)-5-nitro-pyrimidin-4-yl]-1,1-dimethyl-hydrazine CAS Name: 1,1-dimethyl-2-[5-nitro-6-[4-(phenylmethyl)-1-piperazinyl]-4-pyrimidinyl]hydrazine IUPAC Name: 2-[6-(4-benzylpiperazin-1-yl)-5-nitropyrimidin-4-yl]-1,1-dimethylhydrazine Traditional Name: 2-[6-(4-benzylpiperazino)-5-nitro-pyrimidin-4-yl]-1,1-dimethyl-hydrazine Formula: C17H23N7O2 MolecularWeight: 357.41022

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)NC1=NC=NC(=C1[N+](=O)[O-])N2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CN(C)NC1=NC=NC(=C1[N+](=O)[O-])N2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C17H23N7O2/c1-21(2)20-16-15(24(25)26)17(19-13-18-16)23-10-8-22(9-11-23)12-14-6-4-3-5-7-14/h3-7,13H,8-12H2,1-2H3,(H,18,19,20)