2-[4-[2-(9-oxidanylideneacridin-10-yl)ethanoyl]piperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 2-[4-[2-(9-oxidanylideneacridin-10-yl)ethanoyl]piperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 2-[4-[2-(9-oxoacridin-10-yl)acetyl]piperazin-1-yl]sulfonylbenzonitrile CAS Name: 2-[[4-[1-oxo-2-(9-oxo-10-acridinyl)ethyl]-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 2-[4-[2-(9-oxoacridin-10-yl)acetyl]piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 2-[4-[2-(9-ketoacridin-10-yl)acetyl]piperazino]sulfonylbenzonitrile Formula: C26H22N4O4S MolecularWeight: 486.54228

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CN2C3=CC=CC=C3C(=O)C4=CC=CC=C42)S(=O)(=O)C5=CC=CC=C5C#N

Isomeric SMILES

C1CN(CCN1C(=O)CN2C3=CC=CC=C3C(=O)C4=CC=CC=C42)S(=O)(=O)C5=CC=CC=C5C#N

InChI

InChI=1S/C26H22N4O4S/c27-17-19-7-1-6-12-24(19)35(33,34)29-15-13-28(14-16-29)25(31)18-30-22-10-4-2-8-20(22)26(32)21-9-3-5-11-23(21)30/h1-12H,13-16,18H2