N4-naphthalen-1-yl-5-nitro-N6-phenethyl-pyrimidine-4,6-diamine

Systemtic Name: N4-naphthalen-1-yl-5-nitro-N6-phenethyl-pyrimidine-4,6-diamine Openeye Name: N4-(1-naphthyl)-5-nitro-N6-phenethyl-pyrimidine-4,6-diamine CAS Name: N4-(1-naphthalenyl)-5-nitro-N6-phenethylpyrimidine-4,6-diamine IUPAC Name: 4-N-naphthalen-1-yl-5-nitro-6-N-phenethylpyrimidine-4,6-diamine Traditional Name: 1-naphthyl-[5-nitro-6-(phenethylamino)pyrimidin-4-yl]amine Formula: C22H19N5O2 MolecularWeight: 385.41856

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H19N5O2/c28-27(29)20-21(23-14-13-16-7-2-1-3-8-16)24-15-25-22(20)26-19-12-6-10-17-9-4-5-11-18(17)19/h1-12,15H,13-14H2,(H2,23,24,25,26)