2-(3,4-dimethylphenyl)sulfanyl-1-(2,5-dimethyl-1H-pyrrol-3-yl)ethanone

Systemtic Name: 2-(3,4-dimethylphenyl)sulfanyl-1-(2,5-dimethyl-1H-pyrrol-3-yl)ethanone Openeye Name: 2-(3,4-dimethylphenyl)sulfanyl-1-(2,5-dimethyl-1H-pyrrol-3-yl)ethanone CAS Name: 2-[(3,4-dimethylphenyl)thio]-1-(2,5-dimethyl-1H-pyrrol-3-yl)ethanone IUPAC Name: 2-(3,4-dimethylphenyl)sulfanyl-1-(2,5-dimethyl-1H-pyrrol-3-yl)ethanone Traditional Name: 2-[(3,4-dimethylphenyl)thio]-1-(2,5-dimethyl-1H-pyrrol-3-yl)ethanone Formula: C16H19NOS MolecularWeight: 273.39316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SCC(=O)C2=C(NC(=C2)C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)SCC(=O)C2=C(NC(=C2)C)C)C

InChI

InChI=1S/C16H19NOS/c1-10-5-6-14(7-11(10)2)19-9-16(18)15-8-12(3)17-13(15)4/h5-8,17H,9H2,1-4H3