3,3-bis(methylsulfanyl)-1-(2-phenylmethoxyphenyl)prop-2-en-1-one

Systemtic Name: 3,3-bis(methylsulfanyl)-1-(2-phenylmethoxyphenyl)prop-2-en-1-one Openeye Name: 1-(2-benzyloxyphenyl)-3,3-bis(methylsulfanyl)prop-2-en-1-one CAS Name: 3,3-bis(methylthio)-1-(2-phenylmethoxyphenyl)-2-propen-1-one IUPAC Name: 3,3-bis(methylsulfanyl)-1-(2-phenylmethoxyphenyl)prop-2-en-1-one Traditional Name: 1-(2-benzoxyphenyl)-3,3-bis(methylthio)prop-2-en-1-one Formula: C18H18O2S2 MolecularWeight: 330.46432

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=CC(=O)C1=CC=CC=C1OCC2=CC=CC=C2)SC

Isomeric SMILES

CSC(=CC(=O)C1=CC=CC=C1OCC2=CC=CC=C2)SC

InChI

InChI=1S/C18H18O2S2/c1-21-18(22-2)12-16(19)15-10-6-7-11-17(15)20-13-14-8-4-3-5-9-14/h3-12H,13H2,1-2H3