N-[1-[4-(tert-butylcarbamoyl)-4-cyclohexyl-piperidin-1-yl]-3-(4-fluorophenyl)-1-oxidanylidene-propan-2-yl]-4-methyl-3-phenyl-piperazine-2-carboxamide

Systemtic Name: N-[1-[4-(tert-butylcarbamoyl)-4-cyclohexyl-piperidin-1-yl]-3-(4-fluorophenyl)-1-oxidanylidene-propan-2-yl]-4-methyl-3-phenyl-piperazine-2-carboxamide Openeye Name: N-[2-[4-(tert-butylcarbamoyl)-4-cyclohexyl-1-piperidyl]-1-[(4-fluorophenyl)methyl]-2-oxo-ethyl]-4-methyl-3-phenyl-piperazine-2-carboxamide CAS Name: N-[1-[4-[(tert-butylamino)-oxomethyl]-4-cyclohexyl-1-piperidinyl]-3-(4-fluorophenyl)-1-oxopropan-2-yl]-4-methyl-3-phenyl-2-piperazinecarboxamide IUPAC Name: N-[1-[4-(tert-butylcarbamoyl)-4-cyclohexylpiperidin-1-yl]-3-(4-fluorophenyl)-1-oxopropan-2-yl]-4-methyl-3-phenylpiperazine-2-carboxamide Traditional Name: N-[2-[4-(tert-butylcarbamoyl)-4-cyclohexyl-piperidino]-1-(4-fluorobenzyl)-2-keto-ethyl]-4-methyl-3-phenyl-piperazine-2-carboxamide Formula: C37H52FN5O3 MolecularWeight: 633.838883

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C1(CCN(CC1)C(=O)C(CC2=CC=C(C=C2)F)NC(=O)C3C(N(CCN3)C)C4=CC=CC=C4)C5CCCCC5

Isomeric SMILES

CC(C)(C)NC(=O)C1(CCN(CC1)C(=O)C(CC2=CC=C(C=C2)F)NC(=O)C3C(N(CCN3)C)C4=CC=CC=C4)C5CCCCC5

InChI

InChI=1S/C37H52FN5O3/c1-36(2,3)41-35(46)37(28-13-9-6-10-14-28)19-22-43(23-20-37)34(45)30(25-26-15-17-29(38)18-16-26)40-33(44)31-32(42(4)24-21-39-31)27-11-7-5-8-12-27/h5,7-8,11-12,15-18,28,30-32,39H,6,9-10,13-14,19-25H2,1-4H3,(H,40,44)(H,41,46)