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N4-(diphenylmethyl)-N6-(3-methylbutyl)-5-nitro-pyrimidine-4,6-diamine

N4-(diphenylmethyl)-N6-(3-methylbutyl)-5-nitro-pyrimidine-4,6-diamine

Systemtic Name:N4-(diphenylmethyl)-N6-(3-methylbutyl)-5-nitro-pyrimidine-4,6-diamine
Openeye Name:N4-benzhydryl-N6-isopentyl-5-nitro-pyrimidine-4,6-diamine
CAS Name:N4-(diphenylmethyl)-N6-(3-methylbutyl)-5-nitropyrimidine-4,6-diamine
IUPAC Name:4-N-benzhydryl-6-N-(3-methylbutyl)-5-nitropyrimidine-4,6-diamine
Traditional Name:benzhydryl-[6-(isoamylamino)-5-nitro-pyrimidin-4-yl]amine
Formula: C22H25N5O2
MolecularWeight: 391.4662
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC1=C(C(=NC=N1)NC(C2=CC=CC=C2)C3=CC=CC=C3)[N+](=O)[O-]


Isomeric SMILES

CC(C)CCNC1=C(C(=NC=N1)NC(C2=CC=CC=C2)C3=CC=CC=C3)[N+](=O)[O-]


InChI

InChI=1S/C22H25N5O2/c1-16(2)13-14-23-21-20(27(28)29)22(25-15-24-21)26-19(17-9-5-3-6-10-17)18-11-7-4-8-12-18/h3-12,15-16,19H,13-14H2,1-2H3,(H2,23,24,25,26)


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