3-methyl-2-[2-oxidanylidene-2-[4-(phenylsulfonyl)piperazin-1-yl]ethyl]sulfanyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-methyl-2-[2-oxidanylidene-2-[4-(phenylsulfonyl)piperazin-1-yl]ethyl]sulfanyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[2-[4-(benzenesulfonyl)piperazin-1-yl]-2-oxo-ethyl]sulfanyl-3-methyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[[2-[4-(benzenesulfonyl)-1-piperazinyl]-2-oxoethyl]thio]-3-methyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-[2-[4-(benzenesulfonyl)piperazin-1-yl]-2-oxoethyl]sulfanyl-3-methylthieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[[2-(4-besylpiperazino)-2-keto-ethyl]thio]-3-methyl-thieno[2,3-d]pyrimidin-4-one Formula: C19H20N4O4S3 MolecularWeight: 464.5815

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(N=C1SCC(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4)SC=C2

Isomeric SMILES

CN1C(=O)C2=C(N=C1SCC(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4)SC=C2

InChI

InChI=1S/C19H20N4O4S3/c1-21-18(25)15-7-12-28-17(15)20-19(21)29-13-16(24)22-8-10-23(11-9-22)30(26,27)14-5-3-2-4-6-14/h2-7,12H,8-11,13H2,1H3