1-(4-methylphenyl)-2-sulfanyl-anthracene-9,10-dione

Systemtic Name: 1-(4-methylphenyl)-2-sulfanyl-anthracene-9,10-dione Openeye Name: 1-(p-tolyl)-2-sulfanyl-anthracene-9,10-dione CAS Name: 2-mercapto-1-(4-methylphenyl)anthracene-9,10-dione IUPAC Name: 1-(4-methylphenyl)-2-sulfanylanthracene-9,10-dione Traditional Name: 2-mercapto-1-(p-tolyl)-9,10-anthraquinone Formula: C21H14O2S MolecularWeight: 330.39966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C=CC3=C2C(=O)C4=CC=CC=C4C3=O)S

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C=CC3=C2C(=O)C4=CC=CC=C4C3=O)S

InChI

InChI=1S/C21H14O2S/c1-12-6-8-13(9-7-12)18-17(24)11-10-16-19(18)21(23)15-5-3-2-4-14(15)20(16)22/h2-11,24H,1H3