(E)-1,3-bis(4-methylsulfanylphenyl)but-2-en-1-one hydrochloride

Systemtic Name: (E)-1,3-bis(4-methylsulfanylphenyl)but-2-en-1-one hydrochloride Openeye Name: (E)-1,3-bis(4-methylsulfanylphenyl)but-2-en-1-one hydrochloride CAS Name: (E)-1,3-bis[4-(methylthio)phenyl]-2-buten-1-one hydrochloride IUPAC Name: (E)-1,3-bis(4-methylsulfanylphenyl)but-2-en-1-one hydrochloride Traditional Name: (E)-1,3-bis[4-(methylthio)phenyl]but-2-en-1-one hydrochloride Formula: C18H19ClOS2 MolecularWeight: 350.92586

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)C1=CC=C(C=C1)SC)C2=CC=C(C=C2)SC.Cl

Isomeric SMILES

C/C(=C\C(=O)C1=CC=C(C=C1)SC)/C2=CC=C(C=C2)SC.Cl

InChI

InChI=1S/C18H18OS2.ClH/c1-13(14-4-8-16(20-2)9-5-14)12-18(19)15-6-10-17(21-3)11-7-15;/h4-12H,1-3H3;1H/b13-12+;