4-(azepan-1-ylcarbonyl)-N-[4-[bis(fluoranyl)methoxy]phenyl]piperidine-1-carbothioamide

Systemtic Name: 4-(azepan-1-ylcarbonyl)-N-[4-[bis(fluoranyl)methoxy]phenyl]piperidine-1-carbothioamide Openeye Name: 4-(azepane-1-carbonyl)-N-[4-(difluoromethoxy)phenyl]piperidine-1-carbothioamide CAS Name: 4-[1-azepanyl(oxo)methyl]-N-[4-(difluoromethoxy)phenyl]-1-piperidinecarbothioamide IUPAC Name: 4-(azepane-1-carbonyl)-N-[4-(difluoromethoxy)phenyl]piperidine-1-carbothioamide Traditional Name: 4-(azepane-1-carbonyl)-N-[4-(difluoromethoxy)phenyl]piperidine-1-carbothioamide Formula: C20H27F2N3O2S MolecularWeight: 411.509086

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2CCN(CC2)C(=S)NC3=CC=C(C=C3)OC(F)F

Isomeric SMILES

C1CCCN(CC1)C(=O)C2CCN(CC2)C(=S)NC3=CC=C(C=C3)OC(F)F

InChI

InChI=1S/C20H27F2N3O2S/c21-19(22)27-17-7-5-16(6-8-17)23-20(28)25-13-9-15(10-14-25)18(26)24-11-3-1-2-4-12-24/h5-8,15,19H,1-4,9-14H2,(H,23,28)