1-(4-tert-butylphenyl)sulfanyl-4-methyl-anthracene-9,10-dione

Systemtic Name: 1-(4-tert-butylphenyl)sulfanyl-4-methyl-anthracene-9,10-dione Openeye Name: 1-(4-tert-butylphenyl)sulfanyl-4-methyl-anthracene-9,10-dione CAS Name: 1-[(4-tert-butylphenyl)thio]-4-methylanthracene-9,10-dione IUPAC Name: 1-(4-tert-butylphenyl)sulfanyl-4-methylanthracene-9,10-dione Traditional Name: 1-[(4-tert-butylphenyl)thio]-4-methyl-9,10-anthraquinone Formula: C25H22O2S MolecularWeight: 386.50598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)SC3=CC=C(C=C3)C(C)(C)C)C(=O)C4=CC=CC=C4C2=O

Isomeric SMILES

CC1=C2C(=C(C=C1)SC3=CC=C(C=C3)C(C)(C)C)C(=O)C4=CC=CC=C4C2=O

InChI

InChI=1S/C25H22O2S/c1-15-9-14-20(28-17-12-10-16(11-13-17)25(2,3)4)22-21(15)23(26)18-7-5-6-8-19(18)24(22)27/h5-14H,1-4H3