2-[2-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]sulfanyl-N-(3-methylphenyl)ethanamide

Systemtic Name: 2-[2-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]sulfanyl-N-(3-methylphenyl)ethanamide Openeye Name: 2-[2-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-2-oxo-ethyl]sulfanyl-N-(m-tolyl)acetamide CAS Name: 2-[[2-[4-(3-fluorophenyl)sulfonyl-1-piperazinyl]-2-oxoethyl]thio]-N-(3-methylphenyl)acetamide IUPAC Name: 2-[2-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-2-oxoethyl]sulfanyl-N-(3-methylphenyl)acetamide Traditional Name: 2-[[2-[4-(3-fluorophenyl)sulfonylpiperazino]-2-keto-ethyl]thio]-N-(m-tolyl)acetamide Formula: C21H24FN3O4S2 MolecularWeight: 465.561363

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)CSCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)F

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)CSCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)F

InChI

InChI=1S/C21H24FN3O4S2/c1-16-4-2-6-18(12-16)23-20(26)14-30-15-21(27)24-8-10-25(11-9-24)31(28,29)19-7-3-5-17(22)13-19/h2-7,12-13H,8-11,14-15H2,1H3,(H,23,26)