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

Systemtic Name: N-(2-fluorophenyl)-2-[2-[4-(3-methoxyphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]sulfanyl-ethanamide Openeye Name: N-(2-fluorophenyl)-2-[2-[4-(3-methoxyphenyl)piperazin-1-yl]-2-oxo-ethyl]sulfanyl-acetamide CAS Name: N-(2-fluorophenyl)-2-[[2-[4-(3-methoxyphenyl)-1-piperazinyl]-2-oxoethyl]thio]acetamide IUPAC Name: N-(2-fluorophenyl)-2-[2-[4-(3-methoxyphenyl)piperazin-1-yl]-2-oxoethyl]sulfanylacetamide Traditional Name: N-(2-fluorophenyl)-2-[[2-keto-2-[4-(3-methoxyphenyl)piperazino]ethyl]thio]acetamide Formula: C21H24FN3O3S MolecularWeight: 417.496963

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CCN(CC2)C(=O)CSCC(=O)NC3=CC=CC=C3F

Isomeric SMILES

COC1=CC=CC(=C1)N2CCN(CC2)C(=O)CSCC(=O)NC3=CC=CC=C3F

InChI

InChI=1S/C21H24FN3O3S/c1-28-17-6-4-5-16(13-17)24-9-11-25(12-10-24)21(27)15-29-14-20(26)23-19-8-3-2-7-18(19)22/h2-8,13H,9-12,14-15H2,1H3,(H,23,26)