N6-butyl-5-nitro-N4-phenyl-pyrimidine-4,6-diamine

Systemtic Name: N6-butyl-5-nitro-N4-phenyl-pyrimidine-4,6-diamine Openeye Name: N6-butyl-5-nitro-N4-phenyl-pyrimidine-4,6-diamine CAS Name: N6-butyl-5-nitro-N4-phenylpyrimidine-4,6-diamine IUPAC Name: 6-N-butyl-5-nitro-4-N-phenylpyrimidine-4,6-diamine Traditional Name: (6-anilino-5-nitro-pyrimidin-4-yl)-butyl-amine Formula: C14H17N5O2 MolecularWeight: 287.31708

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NC=NC(=C1[N+](=O)[O-])NC2=CC=CC=C2

Isomeric SMILES

CCCCNC1=NC=NC(=C1[N+](=O)[O-])NC2=CC=CC=C2

InChI

InChI=1S/C14H17N5O2/c1-2-3-9-15-13-12(19(20)21)14(17-10-16-13)18-11-7-5-4-6-8-11/h4-8,10H,2-3,9H2,1H3,(H2,15,16,17,18)