(2S,3R)-3-[3-methyl-5-(phenylmethylsulfanyl)furan-2-yl]-2-prop-2-enyl-cyclopentan-1-one

Systemtic Name: (2S,3R)-3-[3-methyl-5-(phenylmethylsulfanyl)furan-2-yl]-2-prop-2-enyl-cyclopentan-1-one Openeye Name: (2S,3R)-2-allyl-3-(5-benzylsulfanyl-3-methyl-2-furyl)cyclopentanone CAS Name: (2S,3R)-3-[3-methyl-5-(phenylmethylthio)-2-furanyl]-2-prop-2-enyl-1-cyclopentanone IUPAC Name: (2S,3R)-3-(5-benzylsulfanyl-3-methylfuran-2-yl)-2-prop-2-enylcyclopentan-1-one Traditional Name: (2S,3R)-2-allyl-3-[5-(benzylthio)-3-methyl-2-furyl]cyclopentanone Formula: C20H22O2S MolecularWeight: 326.45248

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC(=C1)SCC2=CC=CC=C2)C3CCC(=O)C3CC=C

Isomeric SMILES

CC1=C(OC(=C1)SCC2=CC=CC=C2)[C@@H]3CCC(=O)[C@H]3CC=C

InChI

InChI=1S/C20H22O2S/c1-3-7-16-17(10-11-18(16)21)20-14(2)12-19(22-20)23-13-15-8-5-4-6-9-15/h3-6,8-9,12,16-17H,1,7,10-11,13H2,2H3/t16-,17+/m0/s1