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

Systemtic Name: 3-methyl-N-[[2-pyrrolidin-1-yl-5-(trifluoromethyl)phenyl]carbamothioyl]butanamide Openeye Name: 3-methyl-N-[[2-pyrrolidin-1-yl-5-(trifluoromethyl)phenyl]carbamothioyl]butanamide CAS Name: 3-methyl-N-[[2-(1-pyrrolidinyl)-5-(trifluoromethyl)anilino]-sulfanylidenemethyl]butanamide IUPAC Name: 3-methyl-N-[[2-pyrrolidin-1-yl-5-(trifluoromethyl)phenyl]carbamothioyl]butanamide Traditional Name: 3-methyl-N-[[2-pyrrolidino-5-(trifluoromethyl)phenyl]thiocarbamoyl]butyramide Formula: C17H22F3N3OS MolecularWeight: 373.43629

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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)N2CCCC2

Isomeric SMILES

CC(C)CC(=O)NC(=S)NC1=C(C=CC(=C1)C(F)(F)F)N2CCCC2

InChI

InChI=1S/C17H22F3N3OS/c1-11(2)9-15(24)22-16(25)21-13-10-12(17(18,19)20)5-6-14(13)23-7-3-4-8-23/h5-6,10-11H,3-4,7-9H2,1-2H3,(H2,21,22,24,25)