N-[[1-(4-cyclopropylpiperazin-1-yl)cyclobutyl]-phenyl-methyl]-2-methylsulfanyl-4-(trifluoromethyl)benzamide

Systemtic Name: N-[[1-(4-cyclopropylpiperazin-1-yl)cyclobutyl]-phenyl-methyl]-2-methylsulfanyl-4-(trifluoromethyl)benzamide Openeye Name: N-[[1-(4-cyclopropylpiperazin-1-yl)cyclobutyl]-phenyl-methyl]-2-methylsulfanyl-4-(trifluoromethyl)benzamide CAS Name: N-[[1-(4-cyclopropyl-1-piperazinyl)cyclobutyl]-phenylmethyl]-2-(methylthio)-4-(trifluoromethyl)benzamide IUPAC Name: N-[[1-(4-cyclopropylpiperazin-1-yl)cyclobutyl]-phenylmethyl]-2-methylsulfanyl-4-(trifluoromethyl)benzamide Traditional Name: N-[[1-(4-cyclopropylpiperazino)cyclobutyl]-phenyl-methyl]-2-(methylthio)-4-(trifluoromethyl)benzamide Formula: C27H32F3N3OS MolecularWeight: 503.62269

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=CC(=C1)C(F)(F)F)C(=O)NC(C2=CC=CC=C2)C3(CCC3)N4CCN(CC4)C5CC5

Isomeric SMILES

CSC1=C(C=CC(=C1)C(F)(F)F)C(=O)NC(C2=CC=CC=C2)C3(CCC3)N4CCN(CC4)C5CC5

InChI

InChI=1S/C27H32F3N3OS/c1-35-23-18-20(27(28,29)30)8-11-22(23)25(34)31-24(19-6-3-2-4-7-19)26(12-5-13-26)33-16-14-32(15-17-33)21-9-10-21/h2-4,6-8,11,18,21,24H,5,9-10,12-17H2,1H3,(H,31,34)