1-methylsulfanyl-4-[2-[4-(3,4,5-trimethylcyclopenta-1,4-dien-1-yl)phenyl]ethynyl]benzene

Systemtic Name: 1-methylsulfanyl-4-[2-[4-(3,4,5-trimethylcyclopenta-1,4-dien-1-yl)phenyl]ethynyl]benzene Openeye Name: 1-methylsulfanyl-4-[2-[4-(3,4,5-trimethylcyclopenta-1,4-dien-1-yl)phenyl]ethynyl]benzene CAS Name: 1-(methylthio)-4-[2-[4-(3,4,5-trimethyl-1-cyclopenta-1,4-dienyl)phenyl]ethynyl]benzene IUPAC Name: 1-methylsulfanyl-4-[2-[4-(3,4,5-trimethylcyclopenta-1,4-dien-1-yl)phenyl]ethynyl]benzene Traditional Name: 1-(methylthio)-4-[2-[4-(3,4,5-trimethylcyclopenta-1,4-dien-1-yl)phenyl]ethynyl]benzene Formula: C23H22S MolecularWeight: 330.48578

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Descriptors Computed from Structure

Canonical SMILES:

CC1C=C(C(=C1C)C)C2=CC=C(C=C2)C#CC3=CC=C(C=C3)SC

Isomeric SMILES

CC1C=C(C(=C1C)C)C2=CC=C(C=C2)C#CC3=CC=C(C=C3)SC

InChI

InChI=1S/C23H22S/c1-16-15-23(18(3)17(16)2)21-11-7-19(8-12-21)5-6-20-9-13-22(24-4)14-10-20/h7-16H,1-4H3