2-[(2-methylphenyl)methylsulfanyl]-1-(1H-pyrrol-2-yl)ethanone

Systemtic Name: 2-[(2-methylphenyl)methylsulfanyl]-1-(1H-pyrrol-2-yl)ethanone Openeye Name: 2-(o-tolylmethylsulfanyl)-1-(1H-pyrrol-2-yl)ethanone CAS Name: 2-[(2-methylphenyl)methylthio]-1-(1H-pyrrol-2-yl)ethanone IUPAC Name: 2-[(2-methylphenyl)methylsulfanyl]-1-(1H-pyrrol-2-yl)ethanone Traditional Name: 2-[(2-methylbenzyl)thio]-1-(1H-pyrrol-2-yl)ethanone Formula: C14H15NOS MolecularWeight: 245.34

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSCC(=O)C2=CC=CN2

Isomeric SMILES

CC1=CC=CC=C1CSCC(=O)C2=CC=CN2

InChI

InChI=1S/C14H15NOS/c1-11-5-2-3-6-12(11)9-17-10-14(16)13-7-4-8-15-13/h2-8,15H,9-10H2,1H3