N4-butyl-N6-(diphenylmethyl)-N4-methyl-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N4-butyl-N6-(diphenylmethyl)-N4-methyl-5-nitro-pyrimidine-4,6-diamine Openeye Name: N6-benzhydryl-N4-butyl-N4-methyl-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-butyl-N6-(diphenylmethyl)-N4-methyl-5-nitropyrimidine-4,6-diamine IUPAC Name: 6-N-benzhydryl-4-N-butyl-4-N-methyl-5-nitropyrimidine-4,6-diamine Traditional Name: [6-(benzhydrylamino)-5-nitro-pyrimidin-4-yl]-butyl-methyl-amine Formula: C22H25N5O2 MolecularWeight: 391.4662

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25N5O2/c1-3-4-15-26(2)22-20(27(28)29)21(23-16-24-22)25-19(17-11-7-5-8-12-17)18-13-9-6-10-14-18/h5-14,16,19H,3-4,15H2,1-2H3,(H,23,24,25)