1-cyclopropyl-2-(2-fluorophenyl)-2-[(3Z)-3-(phenylmethylidene)-4-sulfanyl-piperidin-1-yl]ethanone

Systemtic Name: 1-cyclopropyl-2-(2-fluorophenyl)-2-[(3Z)-3-(phenylmethylidene)-4-sulfanyl-piperidin-1-yl]ethanone Openeye Name: 2-[(3Z)-3-benzylidene-4-sulfanyl-1-piperidyl]-1-cyclopropyl-2-(2-fluorophenyl)ethanone CAS Name: 1-cyclopropyl-2-(2-fluorophenyl)-2-[(3Z)-4-mercapto-3-(phenylmethylene)-1-piperidinyl]ethanone IUPAC Name: 2-[(3Z)-3-benzylidene-4-sulfanylpiperidin-1-yl]-1-cyclopropyl-2-(2-fluorophenyl)ethanone Traditional Name: 2-[(3Z)-3-benzal-4-mercapto-piperidino]-1-cyclopropyl-2-(2-fluorophenyl)ethanone Formula: C23H24FNOS MolecularWeight: 381.506163

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H24FNOS/c24-20-9-5-4-8-19(20)22(23(26)17-10-11-17)25-13-12-21(27)18(15-25)14-16-6-2-1-3-7-16/h1-9,14,17,21-22,27H,10-13,15H2/b18-14-