N4-[(4-methoxyphenyl)methyl]-5-nitro-N6-(phenylmethyl)pyrimidine-4,6-diamine

Systemtic Name: N4-[(4-methoxyphenyl)methyl]-5-nitro-N6-(phenylmethyl)pyrimidine-4,6-diamine Openeye Name: N6-benzyl-N4-[(4-methoxyphenyl)methyl]-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-[(4-methoxyphenyl)methyl]-5-nitro-N6-(phenylmethyl)pyrimidine-4,6-diamine IUPAC Name: 6-N-benzyl-4-N-[(4-methoxyphenyl)methyl]-5-nitropyrimidine-4,6-diamine Traditional Name: benzyl-[5-nitro-6-(p-anisylamino)pyrimidin-4-yl]amine Formula: C19H19N5O3 MolecularWeight: 365.38586

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC2=NC=NC(=C2[N+](=O)[O-])NCC3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)CNC2=NC=NC(=C2[N+](=O)[O-])NCC3=CC=CC=C3

InChI

InChI=1S/C19H19N5O3/c1-27-16-9-7-15(8-10-16)12-21-19-17(24(25)26)18(22-13-23-19)20-11-14-5-3-2-4-6-14/h2-10,13H,11-12H2,1H3,(H2,20,21,22,23)