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

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

Systemtic Name:5-nitro-N6-phenethyl-N4-pyridin-4-yl-pyrimidine-4,6-diamine
Openeye Name:5-nitro-N6-phenethyl-N4-(4-pyridyl)pyrimidine-4,6-diamine
CAS Name:5-nitro-N6-phenethyl-N4-pyridin-4-ylpyrimidine-4,6-diamine
IUPAC Name:5-nitro-6-N-phenethyl-4-N-pyridin-4-ylpyrimidine-4,6-diamine
Traditional Name:[5-nitro-6-(phenethylamino)pyrimidin-4-yl]-(4-pyridyl)amine
Formula: C17H16N6O2
MolecularWeight: 336.34794
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=NC=C3


Isomeric SMILES

C1=CC=C(C=C1)CCNC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=NC=C3


InChI

InChI=1S/C17H16N6O2/c24-23(25)15-16(19-11-6-13-4-2-1-3-5-13)20-12-21-17(15)22-14-7-9-18-10-8-14/h1-5,7-10,12H,6,11H2,(H2,18,19,20,21,22)


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