N2-[(4-chlorophenyl)methyl]-5-nitro-6-pyrrolidin-1-yl-pyrimidine-2,4-diamine

Systemtic Name: N2-[(4-chlorophenyl)methyl]-5-nitro-6-pyrrolidin-1-yl-pyrimidine-2,4-diamine Openeye Name: N2-[(4-chlorophenyl)methyl]-5-nitro-6-pyrrolidin-1-yl-pyrimidine-2,4-diamine CAS Name: N2-[(4-chlorophenyl)methyl]-5-nitro-6-(1-pyrrolidinyl)pyrimidine-2,4-diamine IUPAC Name: 2-N-[(4-chlorophenyl)methyl]-5-nitro-6-pyrrolidin-1-ylpyrimidine-2,4-diamine Traditional Name: (4-amino-5-nitro-6-pyrrolidino-pyrimidin-2-yl)-(4-chlorobenzyl)amine Formula: C15H17ClN6O2 MolecularWeight: 348.78748

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C(=NC(=N2)NCC3=CC=C(C=C3)Cl)N)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=C(C(=NC(=N2)NCC3=CC=C(C=C3)Cl)N)[N+](=O)[O-]

InChI

InChI=1S/C15H17ClN6O2/c16-11-5-3-10(4-6-11)9-18-15-19-13(17)12(22(23)24)14(20-15)21-7-1-2-8-21/h3-6H,1-2,7-9H2,(H3,17,18,19,20)