N-[(2S)-4-methylsulfanyl-1-[(3-morpholin-4-ylsulfonylphenyl)amino]-1-oxidanylidene-butan-2-yl]furan-2-carboxamide

Systemtic Name: N-[(2S)-4-methylsulfanyl-1-[(3-morpholin-4-ylsulfonylphenyl)amino]-1-oxidanylidene-butan-2-yl]furan-2-carboxamide Openeye Name: N-[(1S)-3-methylsulfanyl-1-[(3-morpholinosulfonylphenyl)carbamoyl]propyl]furan-2-carboxamide CAS Name: N-[(2S)-4-(methylthio)-1-[3-(4-morpholinylsulfonyl)anilino]-1-oxobutan-2-yl]-2-furancarboxamide IUPAC Name: N-[(2S)-4-methylsulfanyl-1-(3-morpholin-4-ylsulfonylanilino)-1-oxobutan-2-yl]furan-2-carboxamide Traditional Name: N-[(1S)-3-(methylthio)-1-[(3-morpholinosulfonylphenyl)carbamoyl]propyl]-2-furamide Formula: C20H25N3O6S2 MolecularWeight: 467.559

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NC1=CC(=CC=C1)S(=O)(=O)N2CCOCC2)NC(=O)C3=CC=CO3

Isomeric SMILES

CSCC[C@@H](C(=O)NC1=CC(=CC=C1)S(=O)(=O)N2CCOCC2)NC(=O)C3=CC=CO3

InChI

InChI=1S/C20H25N3O6S2/c1-30-13-7-17(22-20(25)18-6-3-10-29-18)19(24)21-15-4-2-5-16(14-15)31(26,27)23-8-11-28-12-9-23/h2-6,10,14,17H,7-9,11-13H2,1H3,(H,21,24)(H,22,25)/t17-/m0/s1