2,2-dimethyl-N-[[2-pyrrolidin-1-yl-5-(trifluoromethyl)phenyl]carbamothioyl]propanamide

Systemtic Name: 2,2-dimethyl-N-[[2-pyrrolidin-1-yl-5-(trifluoromethyl)phenyl]carbamothioyl]propanamide Openeye Name: 2,2-dimethyl-N-[[2-pyrrolidin-1-yl-5-(trifluoromethyl)phenyl]carbamothioyl]propanamide CAS Name: 2,2-dimethyl-N-[[2-(1-pyrrolidinyl)-5-(trifluoromethyl)anilino]-sulfanylidenemethyl]propanamide IUPAC Name: 2,2-dimethyl-N-[[2-pyrrolidin-1-yl-5-(trifluoromethyl)phenyl]carbamothioyl]propanamide Traditional Name: 2,2-dimethyl-N-[[2-pyrrolidino-5-(trifluoromethyl)phenyl]thiocarbamoyl]propionamide Formula: C17H22F3N3OS MolecularWeight: 373.43629

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H22F3N3OS/c1-16(2,3)14(24)22-15(25)21-12-10-11(17(18,19)20)6-7-13(12)23-8-4-5-9-23/h6-7,10H,4-5,8-9H2,1-3H3,(H2,21,22,24,25)