1-[2-methylsulfanyl-1-(phenylmethyl)pyrrol-3-yl]ethanone

Systemtic Name: 1-[2-methylsulfanyl-1-(phenylmethyl)pyrrol-3-yl]ethanone Openeye Name: 1-(1-benzyl-2-methylsulfanyl-pyrrol-3-yl)ethanone CAS Name: 1-[2-(methylthio)-1-(phenylmethyl)-3-pyrrolyl]ethanone IUPAC Name: 1-(1-benzyl-2-methylsulfanylpyrrol-3-yl)ethanone Traditional Name: 1-[1-benzyl-2-(methylthio)pyrrol-3-yl]ethanone Formula: C14H15NOS MolecularWeight: 245.34

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(N(C=C1)CC2=CC=CC=C2)SC

Isomeric SMILES

CC(=O)C1=C(N(C=C1)CC2=CC=CC=C2)SC

InChI

InChI=1S/C14H15NOS/c1-11(16)13-8-9-15(14(13)17-2)10-12-6-4-3-5-7-12/h3-9H,10H2,1-2H3