N2,N4-bis[(E)-(3-chlorophenyl)methylideneamino]-5-nitro-pyrimidine-2,4-diamine

Systemtic Name: N2,N4-bis[(E)-(3-chlorophenyl)methylideneamino]-5-nitro-pyrimidine-2,4-diamine Openeye Name: N2,N4-bis[(E)-(3-chlorophenyl)methyleneamino]-5-nitro-pyrimidine-2,4-diamine CAS Name: N2,N4-bis[(E)-(3-chlorophenyl)methylideneamino]-5-nitropyrimidine-2,4-diamine IUPAC Name: 2-N,4-N-bis[(E)-(3-chlorophenyl)methylideneamino]-5-nitropyrimidine-2,4-diamine Traditional Name: [(E)-(3-chlorobenzylidene)amino]-[2-[(N'E)-N'-(3-chlorobenzylidene)hydrazino]-5-nitro-pyrimidin-4-yl]amine Formula: C18H13Cl2N7O2 MolecularWeight: 430.24752

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H13Cl2N7O2/c19-14-5-1-3-12(7-14)9-22-25-17-16(27(28)29)11-21-18(24-17)26-23-10-13-4-2-6-15(20)8-13/h1-11H,(H2,21,24,25,26)/b22-9+,23-10+