N-(3-methylbutyl)-6-(4-methylpiperazin-1-yl)-5-nitro-pyrimidin-4-amine

Systemtic Name: N-(3-methylbutyl)-6-(4-methylpiperazin-1-yl)-5-nitro-pyrimidin-4-amine Openeye Name: N-isopentyl-6-(4-methylpiperazin-1-yl)-5-nitro-pyrimidin-4-amine CAS Name: N-(3-methylbutyl)-6-(4-methyl-1-piperazinyl)-5-nitro-4-pyrimidinamine IUPAC Name: N-(3-methylbutyl)-6-(4-methylpiperazin-1-yl)-5-nitropyrimidin-4-amine Traditional Name: isoamyl-[6-(4-methylpiperazino)-5-nitro-pyrimidin-4-yl]amine Formula: C14H24N6O2 MolecularWeight: 308.37936

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC1=NC=NC(=C1[N+](=O)[O-])N2CCN(CC2)C

Isomeric SMILES

CC(C)CCNC1=NC=NC(=C1[N+](=O)[O-])N2CCN(CC2)C

InChI

InChI=1S/C14H24N6O2/c1-11(2)4-5-15-13-12(20(21)22)14(17-10-16-13)19-8-6-18(3)7-9-19/h10-11H,4-9H2,1-3H3,(H,15,16,17)