N-[4-(dimethylamino)-4-[(4-fluorophenyl)methyl]cyclohexyl]-1-phenyl-5-propyl-pyrazole-4-carboxamide

Systemtic Name: N-[4-(dimethylamino)-4-[(4-fluorophenyl)methyl]cyclohexyl]-1-phenyl-5-propyl-pyrazole-4-carboxamide Openeye Name: N-[4-(dimethylamino)-4-[(4-fluorophenyl)methyl]cyclohexyl]-1-phenyl-5-propyl-pyrazole-4-carboxamide CAS Name: N-[4-(dimethylamino)-4-[(4-fluorophenyl)methyl]cyclohexyl]-1-phenyl-5-propyl-4-pyrazolecarboxamide IUPAC Name: N-[4-(dimethylamino)-4-[(4-fluorophenyl)methyl]cyclohexyl]-1-phenyl-5-propylpyrazole-4-carboxamide Traditional Name: N-[4-(dimethylamino)-4-(4-fluorobenzyl)cyclohexyl]-1-phenyl-5-propyl-pyrazole-4-carboxamide Formula: C28H35FN4O MolecularWeight: 462.602103

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=NN1C2=CC=CC=C2)C(=O)NC3CCC(CC3)(CC4=CC=C(C=C4)F)N(C)C

Isomeric SMILES

CCCC1=C(C=NN1C2=CC=CC=C2)C(=O)NC3CCC(CC3)(CC4=CC=C(C=C4)F)N(C)C

InChI

InChI=1S/C28H35FN4O/c1-4-8-26-25(20-30-33(26)24-9-6-5-7-10-24)27(34)31-23-15-17-28(18-16-23,32(2)3)19-21-11-13-22(29)14-12-21/h5-7,9-14,20,23H,4,8,15-19H2,1-3H3,(H,31,34)