N6-(3-methylbutyl)-5-nitro-N4-(2-piperidin-1-ylethyl)pyrimidine-4,6-diamine

Systemtic Name: N6-(3-methylbutyl)-5-nitro-N4-(2-piperidin-1-ylethyl)pyrimidine-4,6-diamine Openeye Name: N6-isopentyl-5-nitro-N4-[2-(1-piperidyl)ethyl]pyrimidine-4,6-diamine CAS Name: N6-(3-methylbutyl)-5-nitro-N4-[2-(1-piperidinyl)ethyl]pyrimidine-4,6-diamine IUPAC Name: 6-N-(3-methylbutyl)-5-nitro-4-N-(2-piperidin-1-ylethyl)pyrimidine-4,6-diamine Traditional Name: isoamyl-[5-nitro-6-(2-piperidinoethylamino)pyrimidin-4-yl]amine Formula: C16H28N6O2 MolecularWeight: 336.43252

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC1=C(C(=NC=N1)NCCN2CCCCC2)[N+](=O)[O-]

Isomeric SMILES

CC(C)CCNC1=C(C(=NC=N1)NCCN2CCCCC2)[N+](=O)[O-]

InChI

InChI=1S/C16H28N6O2/c1-13(2)6-7-17-15-14(22(23)24)16(20-12-19-15)18-8-11-21-9-4-3-5-10-21/h12-13H,3-11H2,1-2H3,(H2,17,18,19,20)