2-[2-[[2,3-bis(fluoranyl)phenyl]methylsulfanyl]-4-oxidanylidene-5,6,7,7a-tetrahydro-4aH-cyclopenta[b]pyridin-1-yl]-N-(2-diethylaminoethyl)-N-[[4-[4-(trifluoromethyl)phenyl]phenyl]methyl]ethanamide

Systemtic Name: 2-[2-[[2,3-bis(fluoranyl)phenyl]methylsulfanyl]-4-oxidanylidene-5,6,7,7a-tetrahydro-4aH-cyclopenta[b]pyridin-1-yl]-N-(2-diethylaminoethyl)-N-[[4-[4-(trifluoromethyl)phenyl]phenyl]methyl]ethanamide Openeye Name: N-(2-diethylaminoethyl)-2-[2-[(2,3-difluorophenyl)methylsulfanyl]-4-oxo-5,6,7,7a-tetrahydro-4aH-cyclopenta[b]pyridin-1-yl]-N-[[4-[4-(trifluoromethyl)phenyl]phenyl]methyl]acetamide CAS Name: N-(2-diethylaminoethyl)-2-[2-[(2,3-difluorophenyl)methylthio]-4-oxo-5,6,7,7a-tetrahydro-4aH-cyclopenta[b]pyridin-1-yl]-N-[[4-[4-(trifluoromethyl)phenyl]phenyl]methyl]acetamide IUPAC Name: N-(2-diethylaminoethyl)-2-[2-[(2,3-difluorophenyl)methylsulfanyl]-4-oxo-5,6,7,7a-tetrahydro-4aH-cyclopenta[b]pyridin-1-yl]-N-[[4-[4-(trifluoromethyl)phenyl]phenyl]methyl]acetamide Traditional Name: N-(2-diethylaminoethyl)-2-[2-[(2,3-difluorobenzyl)thio]-4-keto-5,6,7,7a-tetrahydro-4aH-1-pyrindin-1-yl]-N-[4-[4-(trifluoromethyl)phenyl]benzyl]acetamide Formula: C37H40F5N3O2S MolecularWeight: 685.789416

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN(CC1=CC=C(C=C1)C2=CC=C(C=C2)C(F)(F)F)C(=O)CN3C4CCCC4C(=O)C=C3SCC5=C(C(=CC=C5)F)F

Isomeric SMILES

CCN(CC)CCN(CC1=CC=C(C=C1)C2=CC=C(C=C2)C(F)(F)F)C(=O)CN3C4CCCC4C(=O)C=C3SCC5=C(C(=CC=C5)F)F

InChI

InChI=1S/C37H40F5N3O2S/c1-3-43(4-2)19-20-44(22-25-11-13-26(14-12-25)27-15-17-29(18-16-27)37(40,41)42)34(47)23-45-32-10-6-8-30(32)33(46)21-35(45)48-24-28-7-5-9-31(38)36(28)39/h5,7,9,11-18,21,30,32H,3-4,6,8,10,19-20,22-24H2,1-2H3