2-(dibutylamino)-1-(4-methylsulfanylphenyl)ethanone

Systemtic Name: 2-(dibutylamino)-1-(4-methylsulfanylphenyl)ethanone Openeye Name: 2-(dibutylamino)-1-(4-methylsulfanylphenyl)ethanone CAS Name: 2-(dibutylamino)-1-[4-(methylthio)phenyl]ethanone IUPAC Name: 2-(dibutylamino)-1-(4-methylsulfanylphenyl)ethanone Traditional Name: 2-(dibutylamino)-1-[4-(methylthio)phenyl]ethanone Formula: C17H27NOS MolecularWeight: 293.46738

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)CC(=O)C1=CC=C(C=C1)SC

Isomeric SMILES

CCCCN(CCCC)CC(=O)C1=CC=C(C=C1)SC

InChI

InChI=1S/C17H27NOS/c1-4-6-12-18(13-7-5-2)14-17(19)15-8-10-16(20-3)11-9-15/h8-11H,4-7,12-14H2,1-3H3