5-ethyl-6-[4-(methylamino)-3-nitro-phenyl]pyrimidine-2,4-diamine

Systemtic Name: 5-ethyl-6-[4-(methylamino)-3-nitro-phenyl]pyrimidine-2,4-diamine Openeye Name: 5-ethyl-6-[4-(methylamino)-3-nitro-phenyl]pyrimidine-2,4-diamine CAS Name: 5-ethyl-6-[4-(methylamino)-3-nitrophenyl]pyrimidine-2,4-diamine IUPAC Name: 5-ethyl-6-[4-(methylamino)-3-nitrophenyl]pyrimidine-2,4-diamine Traditional Name: [4-(2,6-diamino-5-ethyl-pyrimidin-4-yl)-2-nitro-phenyl]-methyl-amine Formula: C13H16N6O2 MolecularWeight: 288.30514

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C(N=C1N)N)C2=CC(=C(C=C2)NC)[N+](=O)[O-]

Isomeric SMILES

CCC1=C(N=C(N=C1N)N)C2=CC(=C(C=C2)NC)[N+](=O)[O-]

InChI

InChI=1S/C13H16N6O2/c1-3-8-11(17-13(15)18-12(8)14)7-4-5-9(16-2)10(6-7)19(20)21/h4-6,16H,3H2,1-2H3,(H4,14,15,17,18)