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N4-(furan-2-ylmethyl)-N2-[(4-methylphenyl)methyl]-5-nitro-pyrimidine-2,4,6-triamine

N4-(furan-2-ylmethyl)-N2-[(4-methylphenyl)methyl]-5-nitro-pyrimidine-2,4,6-triamine

Systemtic Name:N4-(furan-2-ylmethyl)-N2-[(4-methylphenyl)methyl]-5-nitro-pyrimidine-2,4,6-triamine
Openeye Name:N4-(2-furylmethyl)-5-nitro-N2-(p-tolylmethyl)pyrimidine-2,4,6-triamine
CAS Name:N4-(2-furanylmethyl)-N2-[(4-methylphenyl)methyl]-5-nitropyrimidine-2,4,6-triamine
IUPAC Name:4-N-(furan-2-ylmethyl)-2-N-[(4-methylphenyl)methyl]-5-nitropyrimidine-2,4,6-triamine
Traditional Name:[4-amino-6-(2-furfurylamino)-5-nitro-pyrimidin-2-yl]-(4-methylbenzyl)amine
Formula: C17H18N6O3
MolecularWeight: 354.36322
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC2=NC(=C(C(=N2)NCC3=CC=CO3)[N+](=O)[O-])N


Isomeric SMILES

CC1=CC=C(C=C1)CNC2=NC(=C(C(=N2)NCC3=CC=CO3)[N+](=O)[O-])N


InChI

InChI=1S/C17H18N6O3/c1-11-4-6-12(7-5-11)9-20-17-21-15(18)14(23(24)25)16(22-17)19-10-13-3-2-8-26-13/h2-8H,9-10H2,1H3,(H4,18,19,20,21,22)


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