1-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-2-thieno[3,2-d]pyrimidin-4-ylsulfanyl-ethanone

Systemtic Name: 1-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-2-thieno[3,2-d]pyrimidin-4-ylsulfanyl-ethanone Openeye Name: 1-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-2-thieno[3,2-d]pyrimidin-4-ylsulfanyl-ethanone CAS Name: 1-[4-(3-fluorophenyl)sulfonyl-1-piperazinyl]-2-(4-thieno[3,2-d]pyrimidinylthio)ethanone IUPAC Name: 1-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-2-thieno[3,2-d]pyrimidin-4-ylsulfanylethanone Traditional Name: 1-[4-(3-fluorophenyl)sulfonylpiperazino]-2-(thieno[3,2-d]pyrimidin-4-ylthio)ethanone Formula: C18H17FN4O3S3 MolecularWeight: 452.545983

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CSC2=NC=NC3=C2SC=C3)S(=O)(=O)C4=CC=CC(=C4)F

Isomeric SMILES

C1CN(CCN1C(=O)CSC2=NC=NC3=C2SC=C3)S(=O)(=O)C4=CC=CC(=C4)F

InChI

InChI=1S/C18H17FN4O3S3/c19-13-2-1-3-14(10-13)29(25,26)23-7-5-22(6-8-23)16(24)11-28-18-17-15(4-9-27-17)20-12-21-18/h1-4,9-10,12H,5-8,11H2