5-nitro-N4-(phenylmethyl)-N6-propyl-N4-pyridin-2-yl-pyrimidine-4,6-diamine

Systemtic Name: 5-nitro-N4-(phenylmethyl)-N6-propyl-N4-pyridin-2-yl-pyrimidine-4,6-diamine Openeye Name: N4-benzyl-5-nitro-N6-propyl-N4-(2-pyridyl)pyrimidine-4,6-diamine CAS Name: 5-nitro-N4-(phenylmethyl)-N6-propyl-N4-(2-pyridinyl)pyrimidine-4,6-diamine IUPAC Name: 4-N-benzyl-5-nitro-6-N-propyl-4-N-pyridin-2-ylpyrimidine-4,6-diamine Traditional Name: benzyl-[5-nitro-6-(propylamino)pyrimidin-4-yl]-(2-pyridyl)amine Formula: C19H20N6O2 MolecularWeight: 364.4011

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=C(C(=NC=N1)N(CC2=CC=CC=C2)C3=CC=CC=N3)[N+](=O)[O-]

Isomeric SMILES

CCCNC1=C(C(=NC=N1)N(CC2=CC=CC=C2)C3=CC=CC=N3)[N+](=O)[O-]

InChI

InChI=1S/C19H20N6O2/c1-2-11-21-18-17(25(26)27)19(23-14-22-18)24(16-10-6-7-12-20-16)13-15-8-4-3-5-9-15/h3-10,12,14H,2,11,13H2,1H3,(H,21,22,23)