N-(5-butan-2-ylsulfanyl-1,3,4-thiadiazol-2-yl)-1-(2-fluorophenyl)piperidine-4-carboxamide

Systemtic Name: N-(5-butan-2-ylsulfanyl-1,3,4-thiadiazol-2-yl)-1-(2-fluorophenyl)piperidine-4-carboxamide Openeye Name: 1-(2-fluorophenyl)-N-(5-sec-butylsulfanyl-1,3,4-thiadiazol-2-yl)piperidine-4-carboxamide CAS Name: N-[5-(butan-2-ylthio)-1,3,4-thiadiazol-2-yl]-1-(2-fluorophenyl)-4-piperidinecarboxamide IUPAC Name: N-(5-butan-2-ylsulfanyl-1,3,4-thiadiazol-2-yl)-1-(2-fluorophenyl)piperidine-4-carboxamide Traditional Name: 1-(2-fluorophenyl)-N-[5-(sec-butylthio)-1,3,4-thiadiazol-2-yl]isonipecotamide Formula: C18H23FN4OS2 MolecularWeight: 394.529823

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)SC1=NN=C(S1)NC(=O)C2CCN(CC2)C3=CC=CC=C3F

Isomeric SMILES

CCC(C)SC1=NN=C(S1)NC(=O)C2CCN(CC2)C3=CC=CC=C3F

InChI

InChI=1S/C18H23FN4OS2/c1-3-12(2)25-18-22-21-17(26-18)20-16(24)13-8-10-23(11-9-13)15-7-5-4-6-14(15)19/h4-7,12-13H,3,8-11H2,1-2H3,(H,20,21,24)