N2,N4-bis(4-methyl-3-nitro-phenyl)pyrimidine-2,4-diamine

Systemtic Name: N2,N4-bis(4-methyl-3-nitro-phenyl)pyrimidine-2,4-diamine Openeye Name: N2,N4-bis(4-methyl-3-nitro-phenyl)pyrimidine-2,4-diamine CAS Name: N2,N4-bis(4-methyl-3-nitrophenyl)pyrimidine-2,4-diamine IUPAC Name: 2-N,4-N-bis(4-methyl-3-nitrophenyl)pyrimidine-2,4-diamine Traditional Name: [2-(4-methyl-3-nitro-anilino)pyrimidin-4-yl]-(4-methyl-3-nitro-phenyl)amine Formula: C18H16N6O4 MolecularWeight: 380.35744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2=NC(=NC=C2)NC3=CC(=C(C=C3)C)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)NC2=NC(=NC=C2)NC3=CC(=C(C=C3)C)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C18H16N6O4/c1-11-3-5-13(9-15(11)23(25)26)20-17-7-8-19-18(22-17)21-14-6-4-12(2)16(10-14)24(27)28/h3-10H,1-2H3,(H2,19,20,21,22)