1-(4-fluorophenyl)sulfonyl-N-(4-methylsulfanyl-1-oxidanylidene-1-phenylazanyl-butan-2-yl)piperidine-4-carboxamide

Systemtic Name: 1-(4-fluorophenyl)sulfonyl-N-(4-methylsulfanyl-1-oxidanylidene-1-phenylazanyl-butan-2-yl)piperidine-4-carboxamide Openeye Name: 1-(4-fluorophenyl)sulfonyl-N-[3-methylsulfanyl-1-(phenylcarbamoyl)propyl]piperidine-4-carboxamide CAS Name: N-[1-anilino-4-(methylthio)-1-oxobutan-2-yl]-1-(4-fluorophenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(1-anilino-4-methylsulfanyl-1-oxobutan-2-yl)-1-(4-fluorophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: 1-(4-fluorophenyl)sulfonyl-N-[3-(methylthio)-1-(phenylcarbamoyl)propyl]isonipecotamide Formula: C23H28FN3O4S2 MolecularWeight: 493.614523

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NC1=CC=CC=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CSCCC(C(=O)NC1=CC=CC=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C23H28FN3O4S2/c1-32-16-13-21(23(29)25-19-5-3-2-4-6-19)26-22(28)17-11-14-27(15-12-17)33(30,31)20-9-7-18(24)8-10-20/h2-10,17,21H,11-16H2,1H3,(H,25,29)(H,26,28)