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

Systemtic Name: N-(5-butan-2-ylsulfanyl-1,3,4-thiadiazol-2-yl)-1-(4-fluorophenyl)carbonyl-piperidine-4-carboxamide Openeye Name: 1-(4-fluorobenzoyl)-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-[(4-fluorophenyl)-oxomethyl]-4-piperidinecarboxamide IUPAC Name: N-(5-butan-2-ylsulfanyl-1,3,4-thiadiazol-2-yl)-1-(4-fluorobenzoyl)piperidine-4-carboxamide Traditional Name: 1-(4-fluorobenzoyl)-N-[5-(sec-butylthio)-1,3,4-thiadiazol-2-yl]isonipecotamide Formula: C19H23FN4O2S2 MolecularWeight: 422.539923

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H23FN4O2S2/c1-3-12(2)27-19-23-22-18(28-19)21-16(25)13-8-10-24(11-9-13)17(26)14-4-6-15(20)7-5-14/h4-7,12-13H,3,8-11H2,1-2H3,(H,21,22,25)