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N4-(furan-2-ylmethyl)-N6-hexadecyl-5-nitro-pyrimidine-4,6-diamine

N4-(furan-2-ylmethyl)-N6-hexadecyl-5-nitro-pyrimidine-4,6-diamine

Systemtic Name:N4-(furan-2-ylmethyl)-N6-hexadecyl-5-nitro-pyrimidine-4,6-diamine
Openeye Name:N4-(2-furylmethyl)-N6-hexadecyl-5-nitro-pyrimidine-4,6-diamine
CAS Name:N4-(2-furanylmethyl)-N6-hexadecyl-5-nitropyrimidine-4,6-diamine
IUPAC Name:4-N-(furan-2-ylmethyl)-6-N-hexadecyl-5-nitropyrimidine-4,6-diamine
Traditional Name:cetyl-[6-(2-furfurylamino)-5-nitro-pyrimidin-4-yl]amine
Formula: C25H41N5O3
MolecularWeight: 459.62474
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNC1=NC=NC(=C1[N+](=O)[O-])NCC2=CC=CO2


Isomeric SMILES

CCCCCCCCCCCCCCCCNC1=NC=NC(=C1[N+](=O)[O-])NCC2=CC=CO2


InChI

InChI=1S/C25H41N5O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-26-24-23(30(31)32)25(29-21-28-24)27-20-22-17-16-19-33-22/h16-17,19,21H,2-15,18,20H2,1H3,(H2,26,27,28,29)


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