1-(4-fluorophenyl)sulfonyl-N-[4-methylsulfanyl-1-oxidanylidene-1-(propan-2-ylamino)butan-2-yl]piperidine-4-carboxamide

Systemtic Name: 1-(4-fluorophenyl)sulfonyl-N-[4-methylsulfanyl-1-oxidanylidene-1-(propan-2-ylamino)butan-2-yl]piperidine-4-carboxamide Openeye Name: 1-(4-fluorophenyl)sulfonyl-N-[1-(isopropylcarbamoyl)-3-methylsulfanyl-propyl]piperidine-4-carboxamide CAS Name: 1-(4-fluorophenyl)sulfonyl-N-[4-(methylthio)-1-oxo-1-(propan-2-ylamino)butan-2-yl]-4-piperidinecarboxamide IUPAC Name: 1-(4-fluorophenyl)sulfonyl-N-[4-methylsulfanyl-1-oxo-1-(propan-2-ylamino)butan-2-yl]piperidine-4-carboxamide Traditional Name: 1-(4-fluorophenyl)sulfonyl-N-[1-(isopropylcarbamoyl)-3-(methylthio)propyl]isonipecotamide Formula: C20H30FN3O4S2 MolecularWeight: 459.598303

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C(CCSC)NC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CC(C)NC(=O)C(CCSC)NC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C20H30FN3O4S2/c1-14(2)22-20(26)18(10-13-29-3)23-19(25)15-8-11-24(12-9-15)30(27,28)17-6-4-16(21)5-7-17/h4-7,14-15,18H,8-13H2,1-3H3,(H,22,26)(H,23,25)