1-tert-butyl-4-(2-phenylethynylsulfanyl)benzene

Systemtic Name: 1-tert-butyl-4-(2-phenylethynylsulfanyl)benzene Openeye Name: 1-tert-butyl-4-(2-phenylethynylsulfanyl)benzene CAS Name: 1-tert-butyl-4-(2-phenylethynylthio)benzene IUPAC Name: 1-tert-butyl-4-(2-phenylethynylsulfanyl)benzene Traditional Name: 1-tert-butyl-4-(2-phenylethynylthio)benzene Formula: C18H18S MolecularWeight: 266.40052

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)SC#CC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)SC#CC2=CC=CC=C2

InChI

InChI=1S/C18H18S/c1-18(2,3)16-9-11-17(12-10-16)19-14-13-15-7-5-4-6-8-15/h4-12H,1-3H3