N6-(4-butylphenyl)-N4,N4-dimethyl-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N6-(4-butylphenyl)-N4,N4-dimethyl-5-nitro-pyrimidine-4,6-diamine Openeye Name: N6-(4-butylphenyl)-N4,N4-dimethyl-5-nitro-pyrimidine-4,6-diamine CAS Name: N6-(4-butylphenyl)-N4,N4-dimethyl-5-nitropyrimidine-4,6-diamine IUPAC Name: 6-N-(4-butylphenyl)-4-N,4-N-dimethyl-5-nitropyrimidine-4,6-diamine Traditional Name: [6-(4-butylanilino)-5-nitro-pyrimidin-4-yl]-dimethyl-amine Formula: C16H21N5O2 MolecularWeight: 315.37024

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC2=C(C(=NC=N2)N(C)C)[N+](=O)[O-]

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC2=C(C(=NC=N2)N(C)C)[N+](=O)[O-]

InChI

InChI=1S/C16H21N5O2/c1-4-5-6-12-7-9-13(10-8-12)19-15-14(21(22)23)16(20(2)3)18-11-17-15/h7-11H,4-6H2,1-3H3,(H,17,18,19)