5-nitro-N4-phenyl-N2-prop-2-enyl-pyrimidine-2,4,6-triamine

Systemtic Name: 5-nitro-N4-phenyl-N2-prop-2-enyl-pyrimidine-2,4,6-triamine Openeye Name: N2-allyl-5-nitro-N4-phenyl-pyrimidine-2,4,6-triamine CAS Name: 5-nitro-N4-phenyl-N2-prop-2-enylpyrimidine-2,4,6-triamine IUPAC Name: 5-nitro-4-N-phenyl-2-N-prop-2-enylpyrimidine-2,4,6-triamine Traditional Name: allyl-(4-amino-6-anilino-5-nitro-pyrimidin-2-yl)amine Formula: C13H14N6O2 MolecularWeight: 286.28926

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC1=NC(=C(C(=N1)NC2=CC=CC=C2)[N+](=O)[O-])N

Isomeric SMILES

C=CCNC1=NC(=C(C(=N1)NC2=CC=CC=C2)[N+](=O)[O-])N

InChI

InChI=1S/C13H14N6O2/c1-2-8-15-13-17-11(14)10(19(20)21)12(18-13)16-9-6-4-3-5-7-9/h2-7H,1,8H2,(H4,14,15,16,17,18)