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

Systemtic Name: 1-cyclopropyl-2-(2-fluorophenyl)-2-[(3Z)-3-(1H-indol-3-ylmethylidene)-4-sulfanyl-piperidin-1-yl]ethanone Openeye Name: 1-cyclopropyl-2-(2-fluorophenyl)-2-[(3Z)-3-(1H-indol-3-ylmethylene)-4-sulfanyl-1-piperidyl]ethanone CAS Name: 1-cyclopropyl-2-(2-fluorophenyl)-2-[(3Z)-3-(1H-indol-3-ylmethylidene)-4-mercapto-1-piperidinyl]ethanone IUPAC Name: 1-cyclopropyl-2-(2-fluorophenyl)-2-[(3Z)-3-(1H-indol-3-ylmethylidene)-4-sulfanylpiperidin-1-yl]ethanone Traditional Name: 1-cyclopropyl-2-(2-fluorophenyl)-2-[(3Z)-3-(1H-indol-3-ylmethylene)-4-mercapto-piperidino]ethanone Formula: C25H25FN2OS MolecularWeight: 420.542203

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)C(C2=CC=CC=C2F)N3CCC(C(=CC4=CNC5=CC=CC=C54)C3)S

Isomeric SMILES

C1CC1C(=O)C(C2=CC=CC=C2F)N3CCC(/C(=C\C4=CNC5=CC=CC=C54)/C3)S

InChI

InChI=1S/C25H25FN2OS/c26-21-7-3-1-6-20(21)24(25(29)16-9-10-16)28-12-11-23(30)18(15-28)13-17-14-27-22-8-4-2-5-19(17)22/h1-8,13-14,16,23-24,27,30H,9-12,15H2/b18-13-