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

Systemtic Name: N-(3-methylbutyl)-5-nitro-6-pyrrolidin-1-yl-pyrimidin-4-amine Openeye Name: N-isopentyl-5-nitro-6-pyrrolidin-1-yl-pyrimidin-4-amine CAS Name: N-(3-methylbutyl)-5-nitro-6-(1-pyrrolidinyl)-4-pyrimidinamine IUPAC Name: N-(3-methylbutyl)-5-nitro-6-pyrrolidin-1-ylpyrimidin-4-amine Traditional Name: isoamyl-(5-nitro-6-pyrrolidino-pyrimidin-4-yl)amine Formula: C13H21N5O2 MolecularWeight: 279.33814

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC1=NC=NC(=C1[N+](=O)[O-])N2CCCC2

Isomeric SMILES

CC(C)CCNC1=NC=NC(=C1[N+](=O)[O-])N2CCCC2

InChI

InChI=1S/C13H21N5O2/c1-10(2)5-6-14-12-11(18(19)20)13(16-9-15-12)17-7-3-4-8-17/h9-10H,3-8H2,1-2H3,(H,14,15,16)