3,3,6-tris(methylsulfanyl)-2-phenyl-2H-chromen-4-one

Systemtic Name: 3,3,6-tris(methylsulfanyl)-2-phenyl-2H-chromen-4-one Openeye Name: 3,3,6-tris(methylsulfanyl)-2-phenyl-chroman-4-one CAS Name: 3,3,6-tris(methylthio)-2-phenyl-3,4-dihydro-2H-1-benzopyran-4-one IUPAC Name: 3,3,6-tris(methylsulfanyl)-2-phenyl-2H-chromen-4-one Traditional Name: 3,3,6-tris(methylthio)-2-phenyl-chroman-4-one Formula: C18H18O2S3 MolecularWeight: 362.52932

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC2=C(C=C1)OC(C(C2=O)(SC)SC)C3=CC=CC=C3

Isomeric SMILES

CSC1=CC2=C(C=C1)OC(C(C2=O)(SC)SC)C3=CC=CC=C3

InChI

InChI=1S/C18H18O2S3/c1-21-13-9-10-15-14(11-13)16(19)18(22-2,23-3)17(20-15)12-7-5-4-6-8-12/h4-11,17H,1-3H3