methyl 1-[[4-[bis(fluoranyl)methoxy]phenyl]carbamothioyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[[4-[bis(fluoranyl)methoxy]phenyl]carbamothioyl]piperidine-4-carboxylate Openeye Name: methyl 1-[[4-(difluoromethoxy)phenyl]carbamothioyl]piperidine-4-carboxylate CAS Name: 1-[[4-(difluoromethoxy)anilino]-sulfanylidenemethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[[4-(difluoromethoxy)phenyl]carbamothioyl]piperidine-4-carboxylate Traditional Name: 1-[[4-(difluoromethoxy)phenyl]thiocarbamoyl]isonipecotic acid methyl ester Formula: C15H18F2N2O3S MolecularWeight: 344.376826

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCN(CC1)C(=S)NC2=CC=C(C=C2)OC(F)F

Isomeric SMILES

COC(=O)C1CCN(CC1)C(=S)NC2=CC=C(C=C2)OC(F)F

InChI

InChI=1S/C15H18F2N2O3S/c1-21-13(20)10-6-8-19(9-7-10)15(23)18-11-2-4-12(5-3-11)22-14(16)17/h2-5,10,14H,6-9H2,1H3,(H,18,23)