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

Systemtic Name: 1-(4-butylphenyl)sulfanyl-4-(4-ethylphenyl)sulfanyl-anthracene-9,10-dione Openeye Name: 1-(4-butylphenyl)sulfanyl-4-(4-ethylphenyl)sulfanyl-anthracene-9,10-dione CAS Name: 1-[(4-butylphenyl)thio]-4-[(4-ethylphenyl)thio]anthracene-9,10-dione IUPAC Name: 1-(4-butylphenyl)sulfanyl-4-(4-ethylphenyl)sulfanylanthracene-9,10-dione Traditional Name: 1-[(4-butylphenyl)thio]-4-[(4-ethylphenyl)thio]-9,10-anthraquinone Formula: C32H28O2S2 MolecularWeight: 508.69352

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)SC2=C3C(=C(C=C2)SC4=CC=C(C=C4)CC)C(=O)C5=CC=CC=C5C3=O

Isomeric SMILES

CCCCC1=CC=C(C=C1)SC2=C3C(=C(C=C2)SC4=CC=C(C=C4)CC)C(=O)C5=CC=CC=C5C3=O

InChI

InChI=1S/C32H28O2S2/c1-3-5-8-22-13-17-24(18-14-22)36-28-20-19-27(35-23-15-11-21(4-2)12-16-23)29-30(28)32(34)26-10-7-6-9-25(26)31(29)33/h6-7,9-20H,3-5,8H2,1-2H3