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

Systemtic Name: N6-(4-butoxyphenyl)-N4-butyl-N4-methyl-5-nitro-pyrimidine-4,6-diamine Openeye Name: N6-(4-butoxyphenyl)-N4-butyl-N4-methyl-5-nitro-pyrimidine-4,6-diamine CAS Name: N6-(4-butoxyphenyl)-N4-butyl-N4-methyl-5-nitropyrimidine-4,6-diamine IUPAC Name: 6-N-(4-butoxyphenyl)-4-N-butyl-4-N-methyl-5-nitropyrimidine-4,6-diamine Traditional Name: [6-(4-butoxyanilino)-5-nitro-pyrimidin-4-yl]-butyl-methyl-amine Formula: C19H27N5O3 MolecularWeight: 373.44938

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)C1=NC=NC(=C1[N+](=O)[O-])NC2=CC=C(C=C2)OCCCC

Isomeric SMILES

CCCCN(C)C1=NC=NC(=C1[N+](=O)[O-])NC2=CC=C(C=C2)OCCCC

InChI

InChI=1S/C19H27N5O3/c1-4-6-12-23(3)19-17(24(25)26)18(20-14-21-19)22-15-8-10-16(11-9-15)27-13-7-5-2/h8-11,14H,4-7,12-13H2,1-3H3,(H,20,21,22)