4-[4-[2-(7-ethyl-1H-indol-3-yl)-2-oxidanylidene-ethyl]piperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 4-[4-[2-(7-ethyl-1H-indol-3-yl)-2-oxidanylidene-ethyl]piperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 4-[4-[2-(7-ethyl-1H-indol-3-yl)-2-oxo-ethyl]piperazin-1-yl]sulfonylbenzonitrile CAS Name: 4-[[4-[2-(7-ethyl-1H-indol-3-yl)-2-oxoethyl]-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 4-[4-[2-(7-ethyl-1H-indol-3-yl)-2-oxoethyl]piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 4-[4-[2-(7-ethyl-1H-indol-3-yl)-2-keto-ethyl]piperazino]sulfonylbenzonitrile Formula: C23H24N4O3S MolecularWeight: 436.52666

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C1NC=C2C(=O)CN3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C#N

Isomeric SMILES

CCC1=CC=CC2=C1NC=C2C(=O)CN3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C23H24N4O3S/c1-2-18-4-3-5-20-21(15-25-23(18)20)22(28)16-26-10-12-27(13-11-26)31(29,30)19-8-6-17(14-24)7-9-19/h3-9,15,25H,2,10-13,16H2,1H3