6-[[4-[4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)piperazin-1-yl]sulfanylphenyl]methyl]-4-(trifluoromethyl)-1H-quinolin-2-one

Systemtic Name: 6-[[4-[4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)piperazin-1-yl]sulfanylphenyl]methyl]-4-(trifluoromethyl)-1H-quinolin-2-one Openeye Name: 6-[[4-[4-(2-oxo-2-pyrrolidin-1-yl-ethyl)piperazin-1-yl]sulfanylphenyl]methyl]-4-(trifluoromethyl)-1H-quinolin-2-one CAS Name: 6-[[4-[[4-[2-oxo-2-(1-pyrrolidinyl)ethyl]-1-piperazinyl]thio]phenyl]methyl]-4-(trifluoromethyl)-1H-quinolin-2-one IUPAC Name: 6-[[4-[4-(2-oxo-2-pyrrolidin-1-ylethyl)piperazin-1-yl]sulfanylphenyl]methyl]-4-(trifluoromethyl)-1H-quinolin-2-one Traditional Name: 6-[4-[[4-(2-keto-2-pyrrolidino-ethyl)piperazino]thio]benzyl]-4-(trifluoromethyl)carbostyril Formula: C27H29F3N4O2S MolecularWeight: 530.60497

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CN2CCN(CC2)SC3=CC=C(C=C3)CC4=CC5=C(C=C4)NC(=O)C=C5C(F)(F)F

Isomeric SMILES

C1CCN(C1)C(=O)CN2CCN(CC2)SC3=CC=C(C=C3)CC4=CC5=C(C=C4)NC(=O)C=C5C(F)(F)F

InChI

InChI=1S/C27H29F3N4O2S/c28-27(29,30)23-17-25(35)31-24-8-5-20(16-22(23)24)15-19-3-6-21(7-4-19)37-34-13-11-32(12-14-34)18-26(36)33-9-1-2-10-33/h3-8,16-17H,1-2,9-15,18H2,(H,31,35)