[2,5-dimethyl-6,6-bis(phenylsulfanyl)hex-5-en-3-yl] ethanoate

Systemtic Name: [2,5-dimethyl-6,6-bis(phenylsulfanyl)hex-5-en-3-yl] ethanoate Openeye Name: [1-isopropyl-3-methyl-4,4-bis(phenylsulfanyl)but-3-enyl] acetate CAS Name: acetic acid [2,5-dimethyl-6,6-bis(phenylthio)hex-5-en-3-yl] ester IUPAC Name: [2,5-dimethyl-6,6-bis(phenylsulfanyl)hex-5-en-3-yl] acetate Traditional Name: acetic acid [1-isopropyl-3-methyl-4,4-bis(phenylthio)but-3-enyl] ester Formula: C22H26O2S2 MolecularWeight: 386.57064

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CC(=C(SC1=CC=CC=C1)SC2=CC=CC=C2)C)OC(=O)C

Isomeric SMILES

CC(C)C(CC(=C(SC1=CC=CC=C1)SC2=CC=CC=C2)C)OC(=O)C

InChI

InChI=1S/C22H26O2S2/c1-16(2)21(24-18(4)23)15-17(3)22(25-19-11-7-5-8-12-19)26-20-13-9-6-10-14-20/h5-14,16,21H,15H2,1-4H3