3-[2-oxidanylidene-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)ethyl]thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-[2-oxidanylidene-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)ethyl]thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[2-oxo-2-[4-(2-thienylsulfonyl)piperazin-1-yl]ethyl]thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[2-oxo-2-(4-thiophen-2-ylsulfonyl-1-piperazinyl)ethyl]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-[2-oxo-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)ethyl]thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-[2-keto-2-[4-(2-thienylsulfonyl)piperazino]ethyl]thieno[2,3-d]pyrimidin-4-one Formula: C16H16N4O4S3 MolecularWeight: 424.51764

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CN2C=NC3=C(C2=O)C=CS3)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCN1C(=O)CN2C=NC3=C(C2=O)C=CS3)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C16H16N4O4S3/c21-13(10-19-11-17-15-12(16(19)22)3-9-26-15)18-4-6-20(7-5-18)27(23,24)14-2-1-8-25-14/h1-3,8-9,11H,4-7,10H2