N-[(2S)-3-methyl-1-oxidanylidene-1-(2-phenylsulfanylethylamino)butan-2-yl]furan-2-carboxamide

Systemtic Name: N-[(2S)-3-methyl-1-oxidanylidene-1-(2-phenylsulfanylethylamino)butan-2-yl]furan-2-carboxamide Openeye Name: N-[(1S)-2-methyl-1-(2-phenylsulfanylethylcarbamoyl)propyl]furan-2-carboxamide CAS Name: N-[(2S)-3-methyl-1-oxo-1-[2-(phenylthio)ethylamino]butan-2-yl]-2-furancarboxamide IUPAC Name: N-[(2S)-3-methyl-1-oxo-1-(2-phenylsulfanylethylamino)butan-2-yl]furan-2-carboxamide Traditional Name: N-[(1S)-2-methyl-1-[2-(phenylthio)ethylcarbamoyl]propyl]-2-furamide Formula: C18H22N2O3S MolecularWeight: 346.44388

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCCSC1=CC=CC=C1)NC(=O)C2=CC=CO2

Isomeric SMILES

CC(C)[C@@H](C(=O)NCCSC1=CC=CC=C1)NC(=O)C2=CC=CO2

InChI

InChI=1S/C18H22N2O3S/c1-13(2)16(20-17(21)15-9-6-11-23-15)18(22)19-10-12-24-14-7-4-3-5-8-14/h3-9,11,13,16H,10,12H2,1-2H3,(H,19,22)(H,20,21)/t16-/m0/s1