5-[1-[(2S,3S)-2,3-bis(oxidanyl)-4-sulfanyl-butyl]sulfanyl-1-thiophen-3-yl-propan-2-yl]-2-methyl-2-phenyl-furan-3-one

Systemtic Name: 5-[1-[(2S,3S)-2,3-bis(oxidanyl)-4-sulfanyl-butyl]sulfanyl-1-thiophen-3-yl-propan-2-yl]-2-methyl-2-phenyl-furan-3-one Openeye Name: 5-[2-[(2S,3S)-2,3-dihydroxy-4-sulfanyl-butyl]sulfanyl-1-methyl-2-(3-thienyl)ethyl]-2-methyl-2-phenyl-furan-3-one CAS Name: 5-[1-[[(2S,3S)-2,3-dihydroxy-4-mercaptobutyl]thio]-1-(3-thiophenyl)propan-2-yl]-2-methyl-2-phenyl-3-furanone IUPAC Name: 5-[1-[(2S,3S)-2,3-dihydroxy-4-sulfanylbutyl]sulfanyl-1-thiophen-3-ylpropan-2-yl]-2-methyl-2-phenylfuran-3-one Traditional Name: 5-[2-[[(2S,3S)-2,3-dihydroxy-4-mercapto-butyl]thio]-1-methyl-2-(3-thienyl)ethyl]-2-methyl-2-phenyl-furan-3-one Formula: C22H26O4S3 MolecularWeight: 450.63444

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=O)C(O1)(C)C2=CC=CC=C2)C(C3=CSC=C3)SCC(C(CS)O)O

Isomeric SMILES

CC(C1=CC(=O)C(O1)(C)C2=CC=CC=C2)C(C3=CSC=C3)SC[C@H]([C@@H](CS)O)O

InChI

InChI=1S/C22H26O4S3/c1-14(19-10-20(25)22(2,26-19)16-6-4-3-5-7-16)21(15-8-9-28-12-15)29-13-18(24)17(23)11-27/h3-10,12,14,17-18,21,23-24,27H,11,13H2,1-2H3/t14?,17-,18-,21?,22?/m1/s1