N-hexadecyl-5-nitro-6-(2-phenylhydrazinyl)pyrimidin-4-amine

Systemtic Name: N-hexadecyl-5-nitro-6-(2-phenylhydrazinyl)pyrimidin-4-amine Openeye Name: N-hexadecyl-5-nitro-6-(2-phenylhydrazino)pyrimidin-4-amine CAS Name: N-hexadecyl-5-nitro-6-(phenylhydrazo)-4-pyrimidinamine IUPAC Name: N-hexadecyl-5-nitro-6-(2-phenylhydrazinyl)pyrimidin-4-amine Traditional Name: cetyl-[5-nitro-6-(N'-phenylhydrazino)pyrimidin-4-yl]amine Formula: C26H42N6O2 MolecularWeight: 470.65068

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNC1=C(C(=NC=N1)NNC2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCCNC1=C(C(=NC=N1)NNC2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C26H42N6O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-18-21-27-25-24(32(33)34)26(29-22-28-25)31-30-23-19-16-15-17-20-23/h15-17,19-20,22,30H,2-14,18,21H2,1H3,(H2,27,28,29,31)