N-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]-3-(trifluoromethyl)cyclohexane-1-carboxamide

Systemtic Name: N-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]-3-(trifluoromethyl)cyclohexane-1-carboxamide Openeye Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-3-(trifluoromethyl)cyclohexanecarboxamide CAS Name: N-[5-(phenylmethylthio)-1,3,4-thiadiazol-2-yl]-3-(trifluoromethyl)-1-cyclohexanecarboxamide IUPAC Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-3-(trifluoromethyl)cyclohexane-1-carboxamide Traditional Name: N-[5-(benzylthio)-1,3,4-thiadiazol-2-yl]-3-(trifluoromethyl)cyclohexanecarboxamide Formula: C17H18F3N3OS2 MolecularWeight: 401.46953

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC(C1)C(F)(F)F)C(=O)NC2=NN=C(S2)SCC3=CC=CC=C3

Isomeric SMILES

C1CC(CC(C1)C(F)(F)F)C(=O)NC2=NN=C(S2)SCC3=CC=CC=C3

InChI

InChI=1S/C17H18F3N3OS2/c18-17(19,20)13-8-4-7-12(9-13)14(24)21-15-22-23-16(26-15)25-10-11-5-2-1-3-6-11/h1-3,5-6,12-13H,4,7-10H2,(H,21,22,24)