10,10-bis(oxidanylidene)-3-(4-phenylpiperazin-1-yl)thioxanthen-9-one

Systemtic Name: 10,10-bis(oxidanylidene)-3-(4-phenylpiperazin-1-yl)thioxanthen-9-one Openeye Name: 10,10-dioxo-3-(4-phenylpiperazin-1-yl)thioxanthen-9-one CAS Name: 10,10-dioxo-3-(4-phenyl-1-piperazinyl)-9-thioxanthenone IUPAC Name: 10,10-dioxo-3-(4-phenylpiperazin-1-yl)thioxanthen-9-one Traditional Name: 10,10-diketo-3-(4-phenylpiperazino)thioxanthen-9-one Formula: C23H20N2O3S MolecularWeight: 404.4815

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C3=CC4=C(C=C3)C(=O)C5=CC=CC=C5S4(=O)=O

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C3=CC4=C(C=C3)C(=O)C5=CC=CC=C5S4(=O)=O

InChI

InChI=1S/C23H20N2O3S/c26-23-19-8-4-5-9-21(19)29(27,28)22-16-18(10-11-20(22)23)25-14-12-24(13-15-25)17-6-2-1-3-7-17/h1-11,16H,12-15H2