(3-butylsulfanyl-1,5-diphenyl-pent-1-en-4-ynyl)benzene

Systemtic Name: (3-butylsulfanyl-1,5-diphenyl-pent-1-en-4-ynyl)benzene Openeye Name: (3-butylsulfanyl-1,5-diphenyl-pent-1-en-4-ynyl)benzene CAS Name: [3-(butylthio)-1,5-diphenylpent-1-en-4-ynyl]benzene IUPAC Name: (3-butylsulfanyl-1,5-diphenylpent-1-en-4-ynyl)benzene Traditional Name: [3-(butylthio)-1,5-diphenyl-pent-1-en-4-ynyl]benzene Formula: C27H26S MolecularWeight: 382.56034

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCSC(C=C(C1=CC=CC=C1)C2=CC=CC=C2)C#CC3=CC=CC=C3

Isomeric SMILES

CCCCSC(C=C(C1=CC=CC=C1)C2=CC=CC=C2)C#CC3=CC=CC=C3

InChI

InChI=1S/C27H26S/c1-2-3-21-28-26(20-19-23-13-7-4-8-14-23)22-27(24-15-9-5-10-16-24)25-17-11-6-12-18-25/h4-18,22,26H,2-3,21H2,1H3