2-[6-methyl-4-oxidanylidene-5-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonyl-thieno[2,3-d]pyrimidin-3-yl]-N-pyridin-3-yl-ethanamide

Systemtic Name: 2-[6-methyl-4-oxidanylidene-5-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonyl-thieno[2,3-d]pyrimidin-3-yl]-N-pyridin-3-yl-ethanamide Openeye Name: 2-[6-methyl-4-oxo-5-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonyl-thieno[2,3-d]pyrimidin-3-yl]-N-(3-pyridyl)acetamide CAS Name: 2-[6-methyl-4-oxo-5-[[4-(2-pyrimidinyl)-1-piperazinyl]sulfonyl]-3-thieno[2,3-d]pyrimidinyl]-N-(3-pyridinyl)acetamide IUPAC Name: 2-[6-methyl-4-oxo-5-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylthieno[2,3-d]pyrimidin-3-yl]-N-pyridin-3-ylacetamide Traditional Name: 2-[4-keto-6-methyl-5-[4-(2-pyrimidyl)piperazino]sulfonyl-thieno[2,3-d]pyrimidin-3-yl]-N-(3-pyridyl)acetamide Formula: C22H22N8O4S2 MolecularWeight: 526.59128

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(S1)N=CN(C2=O)CC(=O)NC3=CN=CC=C3)S(=O)(=O)N4CCN(CC4)C5=NC=CC=N5

Isomeric SMILES

CC1=C(C2=C(S1)N=CN(C2=O)CC(=O)NC3=CN=CC=C3)S(=O)(=O)N4CCN(CC4)C5=NC=CC=N5

InChI

InChI=1S/C22H22N8O4S2/c1-15-19(36(33,34)30-10-8-28(9-11-30)22-24-6-3-7-25-22)18-20(35-15)26-14-29(21(18)32)13-17(31)27-16-4-2-5-23-12-16/h2-7,12,14H,8-11,13H2,1H3,(H,27,31)