N6-(4-butylphenyl)-N4-ethyl-N4-naphthalen-1-yl-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N6-(4-butylphenyl)-N4-ethyl-N4-naphthalen-1-yl-5-nitro-pyrimidine-4,6-diamine Openeye Name: N6-(4-butylphenyl)-N4-ethyl-N4-(1-naphthyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N6-(4-butylphenyl)-N4-ethyl-N4-(1-naphthalenyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 6-N-(4-butylphenyl)-4-N-ethyl-4-N-naphthalen-1-yl-5-nitropyrimidine-4,6-diamine Traditional Name: [6-(4-butylanilino)-5-nitro-pyrimidin-4-yl]-ethyl-(1-naphthyl)amine Formula: C26H27N5O2 MolecularWeight: 441.52488

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC2=C(C(=NC=N2)N(CC)C3=CC=CC4=CC=CC=C43)[N+](=O)[O-]

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC2=C(C(=NC=N2)N(CC)C3=CC=CC4=CC=CC=C43)[N+](=O)[O-]

InChI

InChI=1S/C26H27N5O2/c1-3-5-9-19-14-16-21(17-15-19)29-25-24(31(32)33)26(28-18-27-25)30(4-2)23-13-8-11-20-10-6-7-12-22(20)23/h6-8,10-18H,3-5,9H2,1-2H3,(H,27,28,29)