(1-methyl-2-methylsulfanyl-pyrrol-3-yl)-phenyl-methanone

Systemtic Name: (1-methyl-2-methylsulfanyl-pyrrol-3-yl)-phenyl-methanone Openeye Name: (1-methyl-2-methylsulfanyl-pyrrol-3-yl)-phenyl-methanone CAS Name: [1-methyl-2-(methylthio)-3-pyrrolyl]-phenylmethanone IUPAC Name: (1-methyl-2-methylsulfanylpyrrol-3-yl)-phenylmethanone Traditional Name: [1-methyl-2-(methylthio)pyrrol-3-yl]-phenyl-methanone Formula: C13H13NOS MolecularWeight: 231.31342

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=C1SC)C(=O)C2=CC=CC=C2

Isomeric SMILES

CN1C=CC(=C1SC)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C13H13NOS/c1-14-9-8-11(13(14)16-2)12(15)10-6-4-3-5-7-10/h3-9H,1-2H3