N4-methyl-5-nitro-N4-phenyl-N6-propyl-pyrimidine-4,6-diamine

Systemtic Name: N4-methyl-5-nitro-N4-phenyl-N6-propyl-pyrimidine-4,6-diamine Openeye Name: N4-methyl-5-nitro-N4-phenyl-N6-propyl-pyrimidine-4,6-diamine CAS Name: N4-methyl-5-nitro-N4-phenyl-N6-propylpyrimidine-4,6-diamine IUPAC Name: 4-N-methyl-5-nitro-4-N-phenyl-6-N-propylpyrimidine-4,6-diamine Traditional Name: methyl-[5-nitro-6-(propylamino)pyrimidin-4-yl]-phenyl-amine Formula: C14H17N5O2 MolecularWeight: 287.31708

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=C(C(=NC=N1)N(C)C2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCCNC1=C(C(=NC=N1)N(C)C2=CC=CC=C2)[N+](=O)[O-]

InChI

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