4-[4-[2-(2-methyl-1H-indol-3-yl)-2-oxidanylidene-ethyl]piperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 4-[4-[2-(2-methyl-1H-indol-3-yl)-2-oxidanylidene-ethyl]piperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 4-[4-[2-(2-methyl-1H-indol-3-yl)-2-oxo-ethyl]piperazin-1-yl]sulfonylbenzonitrile CAS Name: 4-[[4-[2-(2-methyl-1H-indol-3-yl)-2-oxoethyl]-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 4-[4-[2-(2-methyl-1H-indol-3-yl)-2-oxoethyl]piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 4-[4-[2-keto-2-(2-methyl-1H-indol-3-yl)ethyl]piperazino]sulfonylbenzonitrile Formula: C22H22N4O3S MolecularWeight: 422.50008

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)C(=O)CN3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C#N

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)C(=O)CN3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C22H22N4O3S/c1-16-22(19-4-2-3-5-20(19)24-16)21(27)15-25-10-12-26(13-11-25)30(28,29)18-8-6-17(14-23)7-9-18/h2-9,24H,10-13,15H2,1H3