3-methyl-N-[[2-piperidin-1-yl-5-(trifluoromethyl)phenyl]carbamothioyl]butanamide

Systemtic Name: 3-methyl-N-[[2-piperidin-1-yl-5-(trifluoromethyl)phenyl]carbamothioyl]butanamide Openeye Name: 3-methyl-N-[[2-(1-piperidyl)-5-(trifluoromethyl)phenyl]carbamothioyl]butanamide CAS Name: 3-methyl-N-[[2-(1-piperidinyl)-5-(trifluoromethyl)anilino]-sulfanylidenemethyl]butanamide IUPAC Name: 3-methyl-N-[[2-piperidin-1-yl-5-(trifluoromethyl)phenyl]carbamothioyl]butanamide Traditional Name: 3-methyl-N-[[2-piperidino-5-(trifluoromethyl)phenyl]thiocarbamoyl]butyramide Formula: C18H24F3N3OS MolecularWeight: 387.46287

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC(=S)NC1=C(C=CC(=C1)C(F)(F)F)N2CCCCC2

Isomeric SMILES

CC(C)CC(=O)NC(=S)NC1=C(C=CC(=C1)C(F)(F)F)N2CCCCC2

InChI

InChI=1S/C18H24F3N3OS/c1-12(2)10-16(25)23-17(26)22-14-11-13(18(19,20)21)6-7-15(14)24-8-4-3-5-9-24/h6-7,11-12H,3-5,8-10H2,1-2H3,(H2,22,23,25,26)