2-(5-tert-butyl-3-oxidanylidene-1-benzothiophen-2-yl)-5-(4-pentylphenyl)-1-benzothiophen-3-one

Systemtic Name: 2-(5-tert-butyl-3-oxidanylidene-1-benzothiophen-2-yl)-5-(4-pentylphenyl)-1-benzothiophen-3-one Openeye Name: 2-(5-tert-butyl-3-oxo-benzothiophen-2-yl)-5-(4-pentylphenyl)benzothiophen-3-one CAS Name: 2-(5-tert-butyl-3-oxo-1-benzothiophen-2-yl)-5-(4-pentylphenyl)-1-benzothiophen-3-one IUPAC Name: 2-(5-tert-butyl-3-oxo-1-benzothiophen-2-yl)-5-(4-pentylphenyl)-1-benzothiophen-3-one Traditional Name: 5-(4-amylphenyl)-2-(5-tert-butyl-3-keto-benzothiophen-2-yl)benzothiophen-3-one Formula: C31H32O2S2 MolecularWeight: 500.71458

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C2=CC3=C(C=C2)SC(C3=O)C4C(=O)C5=C(S4)C=CC(=C5)C(C)(C)C

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C2=CC3=C(C=C2)SC(C3=O)C4C(=O)C5=C(S4)C=CC(=C5)C(C)(C)C

InChI

InChI=1S/C31H32O2S2/c1-5-6-7-8-19-9-11-20(12-10-19)21-13-15-25-23(17-21)27(32)29(34-25)30-28(33)24-18-22(31(2,3)4)14-16-26(24)35-30/h9-18,29-30H,5-8H2,1-4H3