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

Systemtic Name: 2-[1-methyl-5-[2-(4-methylphenyl)-1,3-dithiolan-2-yl]pyrrol-2-yl]ethanenitrile Openeye Name: 2-[1-methyl-5-[2-(p-tolyl)-1,3-dithiolan-2-yl]pyrrol-2-yl]acetonitrile CAS Name: 2-[1-methyl-5-[2-(4-methylphenyl)-1,3-dithiolan-2-yl]-2-pyrrolyl]acetonitrile IUPAC Name: 2-[1-methyl-5-[2-(4-methylphenyl)-1,3-dithiolan-2-yl]pyrrol-2-yl]acetonitrile Traditional Name: 2-[1-methyl-5-[2-(p-tolyl)-1,3-dithiolan-2-yl]pyrrol-2-yl]acetonitrile Formula: C17H18N2S2 MolecularWeight: 314.46822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2(SCCS2)C3=CC=C(N3C)CC#N

Isomeric SMILES

CC1=CC=C(C=C1)C2(SCCS2)C3=CC=C(N3C)CC#N

InChI

InChI=1S/C17H18N2S2/c1-13-3-5-14(6-4-13)17(20-11-12-21-17)16-8-7-15(9-10-18)19(16)2/h3-8H,9,11-12H2,1-2H3