N2-(4-chlorophenyl)-N4-(2-dimethylaminoethyl)-5-nitro-pyrimidine-2,4-diamine

Systemtic Name: N2-(4-chlorophenyl)-N4-(2-dimethylaminoethyl)-5-nitro-pyrimidine-2,4-diamine Openeye Name: N2-(4-chlorophenyl)-N4-(2-dimethylaminoethyl)-5-nitro-pyrimidine-2,4-diamine CAS Name: N2-(4-chlorophenyl)-N4-(2-dimethylaminoethyl)-5-nitropyrimidine-2,4-diamine IUPAC Name: 2-N-(4-chlorophenyl)-4-N-(2-dimethylaminoethyl)-5-nitropyrimidine-2,4-diamine Traditional Name: 2-[[2-(4-chloroanilino)-5-nitro-pyrimidin-4-yl]amino]ethyl-dimethyl-amine Formula: C14H17ClN6O2 MolecularWeight: 336.77678

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNC1=NC(=NC=C1[N+](=O)[O-])NC2=CC=C(C=C2)Cl

Isomeric SMILES

CN(C)CCNC1=NC(=NC=C1[N+](=O)[O-])NC2=CC=C(C=C2)Cl

InChI

InChI=1S/C14H17ClN6O2/c1-20(2)8-7-16-13-12(21(22)23)9-17-14(19-13)18-11-5-3-10(15)4-6-11/h3-6,9H,7-8H2,1-2H3,(H2,16,17,18,19)