2-[[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]methyl]-1H-thieno[3,2-d]pyrimidin-4-one

Systemtic Name: 2-[[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]methyl]-1H-thieno[3,2-d]pyrimidin-4-one Openeye Name: 2-[[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]methyl]-1H-thieno[3,2-d]pyrimidin-4-one CAS Name: 2-[[4-(2,4-dimethylphenyl)sulfonyl-1-piperazinyl]methyl]-1H-thieno[3,2-d]pyrimidin-4-one IUPAC Name: 2-[[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]methyl]-1H-thieno[3,2-d]pyrimidin-4-one Traditional Name: 2-[[4-(2,4-dimethylphenyl)sulfonylpiperazino]methyl]-1H-thieno[3,2-d]pyrimidin-4-one Formula: C19H22N4O3S2 MolecularWeight: 418.53298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=NC(=O)C4=C(N3)C=CS4)C

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=NC(=O)C4=C(N3)C=CS4)C

InChI

InChI=1S/C19H22N4O3S2/c1-13-3-4-16(14(2)11-13)28(25,26)23-8-6-22(7-9-23)12-17-20-15-5-10-27-18(15)19(24)21-17/h3-5,10-11H,6-9,12H2,1-2H3,(H,20,21,24)