1-[1-(2-chloroethyl)pyrrol-2-yl]-2-phenylsulfanyl-ethanone

Systemtic Name: 1-[1-(2-chloroethyl)pyrrol-2-yl]-2-phenylsulfanyl-ethanone Openeye Name: 1-[1-(2-chloroethyl)pyrrol-2-yl]-2-phenylsulfanyl-ethanone CAS Name: 1-[1-(2-chloroethyl)-2-pyrrolyl]-2-(phenylthio)ethanone IUPAC Name: 1-[1-(2-chloroethyl)pyrrol-2-yl]-2-phenylsulfanylethanone Traditional Name: 1-[1-(2-chloroethyl)pyrrol-2-yl]-2-(phenylthio)ethanone Formula: C14H14ClNOS MolecularWeight: 279.78506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCC(=O)C2=CC=CN2CCCl

Isomeric SMILES

C1=CC=C(C=C1)SCC(=O)C2=CC=CN2CCCl

InChI

InChI=1S/C14H14ClNOS/c15-8-10-16-9-4-7-13(16)14(17)11-18-12-5-2-1-3-6-12/h1-7,9H,8,10-11H2