N2,N4-bis[(E)-(4-methylphenyl)methylideneamino]-5-nitro-pyrimidine-2,4-diamine

Systemtic Name: N2,N4-bis[(E)-(4-methylphenyl)methylideneamino]-5-nitro-pyrimidine-2,4-diamine Openeye Name: 5-nitro-N2,N4-bis[(E)-p-tolylmethyleneamino]pyrimidine-2,4-diamine CAS Name: N2,N4-bis[(E)-(4-methylphenyl)methylideneamino]-5-nitropyrimidine-2,4-diamine IUPAC Name: 2-N,4-N-bis[(E)-(4-methylphenyl)methylideneamino]-5-nitropyrimidine-2,4-diamine Traditional Name: [(E)-(4-methylbenzylidene)amino]-[2-[(N'E)-N'-(4-methylbenzylidene)hydrazino]-5-nitro-pyrimidin-4-yl]amine Formula: C20H19N7O2 MolecularWeight: 389.41056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=NNC2=NC(=NC=C2[N+](=O)[O-])NN=CC3=CC=C(C=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)/C=N/NC2=NC(=NC=C2[N+](=O)[O-])N/N=C/C3=CC=C(C=C3)C

InChI

InChI=1S/C20H19N7O2/c1-14-3-7-16(8-4-14)11-22-25-19-18(27(28)29)13-21-20(24-19)26-23-12-17-9-5-15(2)6-10-17/h3-13H,1-2H3,(H2,21,24,25,26)/b22-11+,23-12+