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

Systemtic Name: N2-(4-chlorophenyl)-5-nitro-N4-(2-phenylazanylethyl)pyrimidine-2,4-diamine Openeye Name: N4-(2-anilinoethyl)-N2-(4-chlorophenyl)-5-nitro-pyrimidine-2,4-diamine CAS Name: N4-(2-anilinoethyl)-N2-(4-chlorophenyl)-5-nitropyrimidine-2,4-diamine IUPAC Name: 4-N-(2-anilinoethyl)-2-N-(4-chlorophenyl)-5-nitropyrimidine-2,4-diamine Traditional Name: 2-anilinoethyl-[2-(4-chloroanilino)-5-nitro-pyrimidin-4-yl]amine Formula: C18H17ClN6O2 MolecularWeight: 384.81958

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NCCNC2=NC(=NC=C2[N+](=O)[O-])NC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)NCCNC2=NC(=NC=C2[N+](=O)[O-])NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H17ClN6O2/c19-13-6-8-15(9-7-13)23-18-22-12-16(25(26)27)17(24-18)21-11-10-20-14-4-2-1-3-5-14/h1-9,12,20H,10-11H2,(H2,21,22,23,24)