1,3,5-tris[(E)-2-(4-tert-butylsulfanylphenyl)ethenyl]benzene

Systemtic Name: 1,3,5-tris[(E)-2-(4-tert-butylsulfanylphenyl)ethenyl]benzene Openeye Name: 1,3,5-tris[(E)-2-(4-tert-butylsulfanylphenyl)vinyl]benzene CAS Name: 1,3,5-tris[(E)-2-[4-(tert-butylthio)phenyl]ethenyl]benzene IUPAC Name: 1,3,5-tris[(E)-2-(4-tert-butylsulfanylphenyl)ethenyl]benzene Traditional Name: 1,3,5-tris[(E)-2-[4-(tert-butylthio)phenyl]vinyl]benzene Formula: C42H48S3 MolecularWeight: 649.02552

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)SC1=CC=C(C=C1)C=CC2=CC(=CC(=C2)C=CC3=CC=C(C=C3)SC(C)(C)C)C=CC4=CC=C(C=C4)SC(C)(C)C

Isomeric SMILES

CC(SC1=CC=C(C=C1)/C=C/C2=CC(=CC(=C2)/C=C/C3=CC=C(C=C3)SC(C)(C)C)/C=C/C4=CC=C(C=C4)SC(C)(C)C)(C)C

InChI

InChI=1S/C42H48S3/c1-40(2,3)43-37-22-16-31(17-23-37)10-13-34-28-35(14-11-32-18-24-38(25-19-32)44-41(4,5)6)30-36(29-34)15-12-33-20-26-39(27-21-33)45-42(7,8)9/h10-30H,1-9H3/b13-10+,14-11+,15-12+