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

Systemtic Name: 5-[2-[2,3-bis(oxidanyl)-4-sulfanyl-butyl]sulfanyl-2-thiophen-3-yl-ethyl]-2-methyl-2-phenyl-furan-3-one Openeye Name: 5-[2-(2,3-dihydroxy-4-sulfanyl-butyl)sulfanyl-2-(3-thienyl)ethyl]-2-methyl-2-phenyl-furan-3-one CAS Name: 5-[2-[(2,3-dihydroxy-4-mercaptobutyl)thio]-2-(3-thiophenyl)ethyl]-2-methyl-2-phenyl-3-furanone IUPAC Name: 5-[2-(2,3-dihydroxy-4-sulfanylbutyl)sulfanyl-2-thiophen-3-ylethyl]-2-methyl-2-phenylfuran-3-one Traditional Name: 5-[2-[(2,3-dihydroxy-4-mercapto-butyl)thio]-2-(3-thienyl)ethyl]-2-methyl-2-phenyl-furan-3-one Formula: C21H24O4S3 MolecularWeight: 436.60786

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)C=C(O1)CC(C2=CSC=C2)SCC(C(CS)O)O)C3=CC=CC=C3

Isomeric SMILES

CC1(C(=O)C=C(O1)CC(C2=CSC=C2)SCC(C(CS)O)O)C3=CC=CC=C3

InChI

InChI=1S/C21H24O4S3/c1-21(15-5-3-2-4-6-15)20(24)10-16(25-21)9-19(14-7-8-27-12-14)28-13-18(23)17(22)11-26/h2-8,10,12,17-19,22-23,26H,9,11,13H2,1H3