2-methyl-3-methylsulfanyl-naphthalene-1,4-dione

Systemtic Name: 2-methyl-3-methylsulfanyl-naphthalene-1,4-dione Openeye Name: 2-methyl-3-methylsulfanyl-naphthalene-1,4-dione CAS Name: 2-methyl-3-(methylthio)naphthalene-1,4-dione IUPAC Name: 2-methyl-3-methylsulfanylnaphthalene-1,4-dione Traditional Name: 2-methyl-3-(methylthio)-1,4-naphthoquinone Formula: C12H10O2S MolecularWeight: 218.2716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=CC=CC=C2C1=O)SC

Isomeric SMILES

CC1=C(C(=O)C2=CC=CC=C2C1=O)SC

InChI

InChI=1S/C12H10O2S/c1-7-10(13)8-5-3-4-6-9(8)11(14)12(7)15-2/h3-6H,1-2H3