N-[(4-chlorophenyl)methyl]-5-nitro-6-[4-(phenylmethyl)piperidin-1-yl]pyrimidin-4-amine

Systemtic Name: N-[(4-chlorophenyl)methyl]-5-nitro-6-[4-(phenylmethyl)piperidin-1-yl]pyrimidin-4-amine Openeye Name: 6-(4-benzyl-1-piperidyl)-N-[(4-chlorophenyl)methyl]-5-nitro-pyrimidin-4-amine CAS Name: N-[(4-chlorophenyl)methyl]-5-nitro-6-[4-(phenylmethyl)-1-piperidinyl]-4-pyrimidinamine IUPAC Name: 6-(4-benzylpiperidin-1-yl)-N-[(4-chlorophenyl)methyl]-5-nitropyrimidin-4-amine Traditional Name: [6-(4-benzylpiperidino)-5-nitro-pyrimidin-4-yl]-(4-chlorobenzyl)amine Formula: C23H24ClN5O2 MolecularWeight: 437.92196

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C3=C(C(=NC=N3)NCC4=CC=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C3=C(C(=NC=N3)NCC4=CC=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C23H24ClN5O2/c24-20-8-6-19(7-9-20)15-25-22-21(29(30)31)23(27-16-26-22)28-12-10-18(11-13-28)14-17-4-2-1-3-5-17/h1-9,16,18H,10-15H2,(H,25,26,27)