N6-(3-methoxyphenyl)-5-nitro-N4,N4-bis(phenylmethyl)pyrimidine-4,6-diamine

Systemtic Name: N6-(3-methoxyphenyl)-5-nitro-N4,N4-bis(phenylmethyl)pyrimidine-4,6-diamine Openeye Name: N4,N4-dibenzyl-N6-(3-methoxyphenyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N6-(3-methoxyphenyl)-5-nitro-N4,N4-bis(phenylmethyl)pyrimidine-4,6-diamine IUPAC Name: 4-N,4-N-dibenzyl-6-N-(3-methoxyphenyl)-5-nitropyrimidine-4,6-diamine Traditional Name: dibenzyl-[6-(m-anisidino)-5-nitro-pyrimidin-4-yl]amine Formula: C25H23N5O3 MolecularWeight: 441.48182

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC2=C(C(=NC=N2)N(CC3=CC=CC=C3)CC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC(=C1)NC2=C(C(=NC=N2)N(CC3=CC=CC=C3)CC4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H23N5O3/c1-33-22-14-8-13-21(15-22)28-24-23(30(31)32)25(27-18-26-24)29(16-19-9-4-2-5-10-19)17-20-11-6-3-7-12-20/h2-15,18H,16-17H2,1H3,(H,26,27,28)