2-methyl-5-[2-(3-oxidanylpropylsulfanyl)-2-thiophen-3-yl-ethyl]-2-phenyl-furan-3-one

Systemtic Name: 2-methyl-5-[2-(3-oxidanylpropylsulfanyl)-2-thiophen-3-yl-ethyl]-2-phenyl-furan-3-one Openeye Name: 5-[2-(3-hydroxypropylsulfanyl)-2-(3-thienyl)ethyl]-2-methyl-2-phenyl-furan-3-one CAS Name: 5-[2-(3-hydroxypropylthio)-2-(3-thiophenyl)ethyl]-2-methyl-2-phenyl-3-furanone IUPAC Name: 5-[2-(3-hydroxypropylsulfanyl)-2-thiophen-3-ylethyl]-2-methyl-2-phenylfuran-3-one Traditional Name: 5-[2-(3-hydroxypropylthio)-2-(3-thienyl)ethyl]-2-methyl-2-phenyl-furan-3-one Formula: C20H22O3S2 MolecularWeight: 374.51688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)C=C(O1)CC(C2=CSC=C2)SCCCO)C3=CC=CC=C3

Isomeric SMILES

CC1(C(=O)C=C(O1)CC(C2=CSC=C2)SCCCO)C3=CC=CC=C3

InChI

InChI=1S/C20H22O3S2/c1-20(16-6-3-2-4-7-16)19(22)13-17(23-20)12-18(25-10-5-9-21)15-8-11-24-14-15/h2-4,6-8,11,13-14,18,21H,5,9-10,12H2,1H3