2-methylsulfanyl-2,4-bis(oxidanyl)-1,6-dihydrobenzo[b][1]benzothiepin-5-one

Systemtic Name: 2-methylsulfanyl-2,4-bis(oxidanyl)-1,6-dihydrobenzo[b][1]benzothiepin-5-one Openeye Name: 2,4-dihydroxy-2-methylsulfanyl-1,6-dihydrobenzo[b][1]benzothiepin-5-one CAS Name: 2,4-dihydroxy-2-(methylthio)-1,6-dihydrobenzo[b][1]benzothiepin-5-one IUPAC Name: 2,4-dihydroxy-2-methylsulfanyl-1,6-dihydrobenzo[b][1]benzothiepin-5-one Traditional Name: 2,4-dihydroxy-2-(methylthio)-1,6-dihydrobenzo[b][1]benzothiepin-5-one Formula: C15H14O3S2 MolecularWeight: 306.39986

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Descriptors Computed from Structure

Canonical SMILES:

CSC1(CC2=C(C(=O)CC3=CC=CC=C3S2)C(=C1)O)O

Isomeric SMILES

CSC1(CC2=C(C(=O)CC3=CC=CC=C3S2)C(=C1)O)O

InChI

InChI=1S/C15H14O3S2/c1-19-15(18)7-11(17)14-10(16)6-9-4-2-3-5-12(9)20-13(14)8-15/h2-5,7,17-18H,6,8H2,1H3