N6-[(4-chlorophenyl)methyl]-N4-cyclohexyl-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N6-[(4-chlorophenyl)methyl]-N4-cyclohexyl-5-nitro-pyrimidine-4,6-diamine Openeye Name: N6-[(4-chlorophenyl)methyl]-N4-cyclohexyl-5-nitro-pyrimidine-4,6-diamine CAS Name: N6-[(4-chlorophenyl)methyl]-N4-cyclohexyl-5-nitropyrimidine-4,6-diamine IUPAC Name: 6-N-[(4-chlorophenyl)methyl]-4-N-cyclohexyl-5-nitropyrimidine-4,6-diamine Traditional Name: (4-chlorobenzyl)-[6-(cyclohexylamino)-5-nitro-pyrimidin-4-yl]amine Formula: C17H20ClN5O2 MolecularWeight: 361.826

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC2=C(C(=NC=N2)NCC3=CC=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)NC2=C(C(=NC=N2)NCC3=CC=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H20ClN5O2/c18-13-8-6-12(7-9-13)10-19-16-15(23(24)25)17(21-11-20-16)22-14-4-2-1-3-5-14/h6-9,11,14H,1-5,10H2,(H2,19,20,21,22)