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

Systemtic Name: N6-[2-(3,4-dimethoxyphenyl)ethyl]-N4-ethyl-N4-naphthalen-1-yl-5-nitro-pyrimidine-4,6-diamine Openeye Name: N6-[2-(3,4-dimethoxyphenyl)ethyl]-N4-ethyl-N4-(1-naphthyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N6-[2-(3,4-dimethoxyphenyl)ethyl]-N4-ethyl-N4-(1-naphthalenyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 6-N-[2-(3,4-dimethoxyphenyl)ethyl]-4-N-ethyl-4-N-naphthalen-1-yl-5-nitropyrimidine-4,6-diamine Traditional Name: ethyl-[6-(homoveratrylamino)-5-nitro-pyrimidin-4-yl]-(1-naphthyl)amine Formula: C26H27N5O4 MolecularWeight: 473.52368

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC2=CC=CC=C21)C3=NC=NC(=C3[N+](=O)[O-])NCCC4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CCN(C1=CC=CC2=CC=CC=C21)C3=NC=NC(=C3[N+](=O)[O-])NCCC4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C26H27N5O4/c1-4-30(21-11-7-9-19-8-5-6-10-20(19)21)26-24(31(32)33)25(28-17-29-26)27-15-14-18-12-13-22(34-2)23(16-18)35-3/h5-13,16-17H,4,14-15H2,1-3H3,(H,27,28,29)