N2-(4-chlorophenyl)-N4-[2-(1-methylpyrrolidin-2-yl)ethyl]-5-nitro-pyrimidine-2,4-diamine

Systemtic Name: N2-(4-chlorophenyl)-N4-[2-(1-methylpyrrolidin-2-yl)ethyl]-5-nitro-pyrimidine-2,4-diamine Openeye Name: N2-(4-chlorophenyl)-N4-[2-(1-methylpyrrolidin-2-yl)ethyl]-5-nitro-pyrimidine-2,4-diamine CAS Name: N2-(4-chlorophenyl)-N4-[2-(1-methyl-2-pyrrolidinyl)ethyl]-5-nitropyrimidine-2,4-diamine IUPAC Name: 2-N-(4-chlorophenyl)-4-N-[2-(1-methylpyrrolidin-2-yl)ethyl]-5-nitropyrimidine-2,4-diamine Traditional Name: [2-(4-chloroanilino)-5-nitro-pyrimidin-4-yl]-[2-(1-methylpyrrolidin-2-yl)ethyl]amine Formula: C17H21ClN6O2 MolecularWeight: 376.84064

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCC1CCNC2=NC(=NC=C2[N+](=O)[O-])NC3=CC=C(C=C3)Cl

Isomeric SMILES

CN1CCCC1CCNC2=NC(=NC=C2[N+](=O)[O-])NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H21ClN6O2/c1-23-10-2-3-14(23)8-9-19-16-15(24(25)26)11-20-17(22-16)21-13-6-4-12(18)5-7-13/h4-7,11,14H,2-3,8-10H2,1H3,(H2,19,20,21,22)