6-(2,3-dihydroindol-1-yl)-N-(3-methylbutyl)-5-nitro-pyrimidin-4-amine

Systemtic Name: 6-(2,3-dihydroindol-1-yl)-N-(3-methylbutyl)-5-nitro-pyrimidin-4-amine Openeye Name: 6-indolin-1-yl-N-isopentyl-5-nitro-pyrimidin-4-amine CAS Name: 6-(2,3-dihydroindol-1-yl)-N-(3-methylbutyl)-5-nitro-4-pyrimidinamine IUPAC Name: 6-(2,3-dihydroindol-1-yl)-N-(3-methylbutyl)-5-nitropyrimidin-4-amine Traditional Name: (6-indolin-1-yl-5-nitro-pyrimidin-4-yl)-isoamyl-amine Formula: C17H21N5O2 MolecularWeight: 327.38094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC1=NC=NC(=C1[N+](=O)[O-])N2CCC3=CC=CC=C32

Isomeric SMILES

CC(C)CCNC1=NC=NC(=C1[N+](=O)[O-])N2CCC3=CC=CC=C32

InChI

InChI=1S/C17H21N5O2/c1-12(2)7-9-18-16-15(22(23)24)17(20-11-19-16)21-10-8-13-5-3-4-6-14(13)21/h3-6,11-12H,7-10H2,1-2H3,(H,18,19,20)