N2-(4-bromanylnaphthalen-1-yl)-N4-(2-methoxyphenyl)-6-methyl-5-nitro-pyrimidine-2,4-diamine

Systemtic Name: N2-(4-bromanylnaphthalen-1-yl)-N4-(2-methoxyphenyl)-6-methyl-5-nitro-pyrimidine-2,4-diamine Openeye Name: N2-(4-bromo-1-naphthyl)-N4-(2-methoxyphenyl)-6-methyl-5-nitro-pyrimidine-2,4-diamine CAS Name: N2-(4-bromo-1-naphthalenyl)-N4-(2-methoxyphenyl)-6-methyl-5-nitropyrimidine-2,4-diamine IUPAC Name: 2-N-(4-bromonaphthalen-1-yl)-4-N-(2-methoxyphenyl)-6-methyl-5-nitropyrimidine-2,4-diamine Traditional Name: (4-bromo-1-naphthyl)-[4-methyl-5-nitro-6-(o-anisidino)pyrimidin-2-yl]amine Formula: C22H18BrN5O3 MolecularWeight: 480.31402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)NC2=CC=C(C3=CC=CC=C32)Br)NC4=CC=CC=C4OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NC(=N1)NC2=CC=C(C3=CC=CC=C32)Br)NC4=CC=CC=C4OC)[N+](=O)[O-]

InChI

InChI=1S/C22H18BrN5O3/c1-13-20(28(29)30)21(25-18-9-5-6-10-19(18)31-2)27-22(24-13)26-17-12-11-16(23)14-7-3-4-8-15(14)17/h3-12H,1-2H3,(H2,24,25,26,27)