2-[4-[2-[1-(2-methylphenyl)imidazol-2-yl]sulfanylethanoyl]piperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 2-[4-[2-[1-(2-methylphenyl)imidazol-2-yl]sulfanylethanoyl]piperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 2-[4-[2-[1-(o-tolyl)imidazol-2-yl]sulfanylacetyl]piperazin-1-yl]sulfonylbenzonitrile CAS Name: 2-[[4-[2-[[1-(2-methylphenyl)-2-imidazolyl]thio]-1-oxoethyl]-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 2-[4-[2-[1-(2-methylphenyl)imidazol-2-yl]sulfanylacetyl]piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 2-[4-[2-[[1-(o-tolyl)imidazol-2-yl]thio]acetyl]piperazino]sulfonylbenzonitrile Formula: C23H23N5O3S2 MolecularWeight: 481.59042

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C=CN=C2SCC(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4C#N

Isomeric SMILES

CC1=CC=CC=C1N2C=CN=C2SCC(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4C#N

InChI

InChI=1S/C23H23N5O3S2/c1-18-6-2-4-8-20(18)28-11-10-25-23(28)32-17-22(29)26-12-14-27(15-13-26)33(30,31)21-9-5-3-7-19(21)16-24/h2-11H,12-15,17H2,1H3