2-[5-[2-(4-chlorophenyl)-1,3-dithiolan-2-yl]-1-methyl-pyrrol-2-yl]ethanenitrile

Systemtic Name: 2-[5-[2-(4-chlorophenyl)-1,3-dithiolan-2-yl]-1-methyl-pyrrol-2-yl]ethanenitrile Openeye Name: 2-[5-[2-(4-chlorophenyl)-1,3-dithiolan-2-yl]-1-methyl-pyrrol-2-yl]acetonitrile CAS Name: 2-[5-[2-(4-chlorophenyl)-1,3-dithiolan-2-yl]-1-methyl-2-pyrrolyl]acetonitrile IUPAC Name: 2-[5-[2-(4-chlorophenyl)-1,3-dithiolan-2-yl]-1-methylpyrrol-2-yl]acetonitrile Traditional Name: 2-[5-[2-(4-chlorophenyl)-1,3-dithiolan-2-yl]-1-methyl-pyrrol-2-yl]acetonitrile Formula: C16H15ClN2S2 MolecularWeight: 334.8867

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=C1C2(SCCS2)C3=CC=C(C=C3)Cl)CC#N

Isomeric SMILES

CN1C(=CC=C1C2(SCCS2)C3=CC=C(C=C3)Cl)CC#N

InChI

InChI=1S/C16H15ClN2S2/c1-19-14(8-9-18)6-7-15(19)16(20-10-11-21-16)12-2-4-13(17)5-3-12/h2-7H,8,10-11H2,1H3