1,5,5-trimethyl-3-phenylsulfanyl-cyclohexa-1,3-diene

Systemtic Name: 1,5,5-trimethyl-3-phenylsulfanyl-cyclohexa-1,3-diene Openeye Name: 1,5,5-trimethyl-3-phenylsulfanyl-cyclohexa-1,3-diene CAS Name: 1,5,5-trimethyl-3-(phenylthio)cyclohexa-1,3-diene IUPAC Name: 1,5,5-trimethyl-3-phenylsulfanylcyclohexa-1,3-diene Traditional Name: 1,5,5-trimethyl-3-(phenylthio)cyclohexa-1,3-diene Formula: C15H18S MolecularWeight: 230.36842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(C1)(C)C)SC2=CC=CC=C2

Isomeric SMILES

CC1=CC(=CC(C1)(C)C)SC2=CC=CC=C2

InChI

InChI=1S/C15H18S/c1-12-9-14(11-15(2,3)10-12)16-13-7-5-4-6-8-13/h4-9,11H,10H2,1-3H3