1-cyclopropyl-2-(2-fluorophenyl)-2-[(3E)-4-sulfanyl-3-(thiophen-3-ylmethylidene)piperidin-1-yl]ethanone

Systemtic Name: 1-cyclopropyl-2-(2-fluorophenyl)-2-[(3E)-4-sulfanyl-3-(thiophen-3-ylmethylidene)piperidin-1-yl]ethanone Openeye Name: 1-cyclopropyl-2-(2-fluorophenyl)-2-[(3E)-4-sulfanyl-3-(3-thienylmethylene)-1-piperidyl]ethanone CAS Name: 1-cyclopropyl-2-(2-fluorophenyl)-2-[(3E)-4-mercapto-3-(3-thiophenylmethylidene)-1-piperidinyl]ethanone IUPAC Name: 1-cyclopropyl-2-(2-fluorophenyl)-2-[(3E)-4-sulfanyl-3-(thiophen-3-ylmethylidene)piperidin-1-yl]ethanone Traditional Name: 1-cyclopropyl-2-(2-fluorophenyl)-2-[(3E)-4-mercapto-3-(3-thenylidene)piperidino]ethanone Formula: C21H22FNOS2 MolecularWeight: 387.533883

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)C(C2=CC=CC=C2F)N3CCC(C(=CC4=CSC=C4)C3)S

Isomeric SMILES

C1CC1C(=O)C(C2=CC=CC=C2F)N3CCC(/C(=C/C4=CSC=C4)/C3)S

InChI

InChI=1S/C21H22FNOS2/c22-18-4-2-1-3-17(18)20(21(24)15-5-6-15)23-9-7-19(25)16(12-23)11-14-8-10-26-13-14/h1-4,8,10-11,13,15,19-20,25H,5-7,9,12H2/b16-11+