N6-[2-(3,4-dimethoxyphenyl)ethyl]-N4-naphthalen-1-yl-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N6-[2-(3,4-dimethoxyphenyl)ethyl]-N4-naphthalen-1-yl-5-nitro-pyrimidine-4,6-diamine Openeye Name: N6-[2-(3,4-dimethoxyphenyl)ethyl]-N4-(1-naphthyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N6-[2-(3,4-dimethoxyphenyl)ethyl]-N4-(1-naphthalenyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 6-N-[2-(3,4-dimethoxyphenyl)ethyl]-4-N-naphthalen-1-yl-5-nitropyrimidine-4,6-diamine Traditional Name: homoveratryl-[6-(1-naphthylamino)-5-nitro-pyrimidin-4-yl]amine Formula: C24H23N5O4 MolecularWeight: 445.47052

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=CC4=CC=CC=C43)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=CC4=CC=CC=C43)OC

InChI

InChI=1S/C24H23N5O4/c1-32-20-11-10-16(14-21(20)33-2)12-13-25-23-22(29(30)31)24(27-15-26-23)28-19-9-5-7-17-6-3-4-8-18(17)19/h3-11,14-15H,12-13H2,1-2H3,(H2,25,26,27,28)