N6-(3-methylbutyl)-5-nitro-N4-phenyl-pyrimidine-4,6-diamine

Systemtic Name: N6-(3-methylbutyl)-5-nitro-N4-phenyl-pyrimidine-4,6-diamine Openeye Name: N6-isopentyl-5-nitro-N4-phenyl-pyrimidine-4,6-diamine CAS Name: N6-(3-methylbutyl)-5-nitro-N4-phenylpyrimidine-4,6-diamine IUPAC Name: 6-N-(3-methylbutyl)-5-nitro-4-N-phenylpyrimidine-4,6-diamine Traditional Name: (6-anilino-5-nitro-pyrimidin-4-yl)-isoamyl-amine Formula: C15H19N5O2 MolecularWeight: 301.34366

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC1=NC=NC(=C1[N+](=O)[O-])NC2=CC=CC=C2

Isomeric SMILES

CC(C)CCNC1=NC=NC(=C1[N+](=O)[O-])NC2=CC=CC=C2

InChI

InChI=1S/C15H19N5O2/c1-11(2)8-9-16-14-13(20(21)22)15(18-10-17-14)19-12-6-4-3-5-7-12/h3-7,10-11H,8-9H2,1-2H3,(H2,16,17,18,19)