(E)-4-(dimethylamino)-3-(4-methylsulfanylphenyl)but-3-en-2-one

Systemtic Name: (E)-4-(dimethylamino)-3-(4-methylsulfanylphenyl)but-3-en-2-one Openeye Name: (E)-4-(dimethylamino)-3-(4-methylsulfanylphenyl)but-3-en-2-one CAS Name: (E)-4-(dimethylamino)-3-[4-(methylthio)phenyl]-3-buten-2-one IUPAC Name: (E)-4-(dimethylamino)-3-(4-methylsulfanylphenyl)but-3-en-2-one Traditional Name: (E)-4-(dimethylamino)-3-[4-(methylthio)phenyl]but-3-en-2-one Formula: C13H17NOS MolecularWeight: 235.34518

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=CN(C)C)C1=CC=C(C=C1)SC

Isomeric SMILES

CC(=O)/C(=C/N(C)C)/C1=CC=C(C=C1)SC

InChI

InChI=1S/C13H17NOS/c1-10(15)13(9-14(2)3)11-5-7-12(16-4)8-6-11/h5-9H,1-4H3/b13-9-