N2-(3,4-dichlorophenyl)-N4-(2-dimethylaminoethyl)-5-nitro-pyrimidine-2,4-diamine

Systemtic Name: N2-(3,4-dichlorophenyl)-N4-(2-dimethylaminoethyl)-5-nitro-pyrimidine-2,4-diamine Openeye Name: N2-(3,4-dichlorophenyl)-N4-(2-dimethylaminoethyl)-5-nitro-pyrimidine-2,4-diamine CAS Name: N2-(3,4-dichlorophenyl)-N4-(2-dimethylaminoethyl)-5-nitropyrimidine-2,4-diamine IUPAC Name: 2-N-(3,4-dichlorophenyl)-4-N-(2-dimethylaminoethyl)-5-nitropyrimidine-2,4-diamine Traditional Name: 2-[[2-(3,4-dichloroanilino)-5-nitro-pyrimidin-4-yl]amino]ethyl-dimethyl-amine Formula: C14H16Cl2N6O2 MolecularWeight: 371.22184

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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)Cl

Isomeric SMILES

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

InChI

InChI=1S/C14H16Cl2N6O2/c1-21(2)6-5-17-13-12(22(23)24)8-18-14(20-13)19-9-3-4-10(15)11(16)7-9/h3-4,7-8H,5-6H2,1-2H3,(H2,17,18,19,20)