4-[4-(4-fluorophenyl)piperazin-1-yl]-N-(9H-thioxanthen-9-yl)butanamide

Systemtic Name: 4-[4-(4-fluorophenyl)piperazin-1-yl]-N-(9H-thioxanthen-9-yl)butanamide Openeye Name: 4-[4-(4-fluorophenyl)piperazin-1-yl]-N-(9H-thioxanthen-9-yl)butanamide CAS Name: 4-[4-(4-fluorophenyl)-1-piperazinyl]-N-(9H-thioxanthen-9-yl)butanamide IUPAC Name: 4-[4-(4-fluorophenyl)piperazin-1-yl]-N-(9H-thioxanthen-9-yl)butanamide Traditional Name: 4-[4-(4-fluorophenyl)piperazino]-N-(9H-thioxanthen-9-yl)butyramide Formula: C27H28FN3OS MolecularWeight: 461.594123

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCC(=O)NC2C3=CC=CC=C3SC4=CC=CC=C24)C5=CC=C(C=C5)F

Isomeric SMILES

C1CN(CCN1CCCC(=O)NC2C3=CC=CC=C3SC4=CC=CC=C24)C5=CC=C(C=C5)F

InChI

InChI=1S/C27H28FN3OS/c28-20-11-13-21(14-12-20)31-18-16-30(17-19-31)15-5-10-26(32)29-27-22-6-1-3-8-24(22)33-25-9-4-2-7-23(25)27/h1-4,6-9,11-14,27H,5,10,15-19H2,(H,29,32)