N-[1-(4-fluorophenyl)sulfonyl-2-oxidanylidene-2-(4-propanoylpiperazin-1-yl)ethyl]thiophene-2-carboxamide

Systemtic Name: N-[1-(4-fluorophenyl)sulfonyl-2-oxidanylidene-2-(4-propanoylpiperazin-1-yl)ethyl]thiophene-2-carboxamide Openeye Name: N-[1-(4-fluorophenyl)sulfonyl-2-oxo-2-(4-propanoylpiperazin-1-yl)ethyl]thiophene-2-carboxamide CAS Name: N-[1-(4-fluorophenyl)sulfonyl-2-oxo-2-[4-(1-oxopropyl)-1-piperazinyl]ethyl]-2-thiophenecarboxamide IUPAC Name: N-[1-(4-fluorophenyl)sulfonyl-2-oxo-2-(4-propanoylpiperazin-1-yl)ethyl]thiophene-2-carboxamide Traditional Name: N-[1-(4-fluorophenyl)sulfonyl-2-keto-2-(4-propionylpiperazino)ethyl]thiophene-2-carboxamide Formula: C20H22FN3O5S2 MolecularWeight: 467.534183

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCN(CC1)C(=O)C(NC(=O)C2=CC=CS2)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CCC(=O)N1CCN(CC1)C(=O)C(NC(=O)C2=CC=CS2)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H22FN3O5S2/c1-2-17(25)23-9-11-24(12-10-23)20(27)19(22-18(26)16-4-3-13-30-16)31(28,29)15-7-5-14(21)6-8-15/h3-8,13,19H,2,9-12H2,1H3,(H,22,26)