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

Systemtic Name: 2-[6-methyl-4-oxidanylidene-5-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonyl-thieno[2,3-d]pyrimidin-3-yl]-N-(3,4,5-trimethoxyphenyl)ethanamide Openeye Name: 2-[6-methyl-4-oxo-5-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonyl-thieno[2,3-d]pyrimidin-3-yl]-N-(3,4,5-trimethoxyphenyl)acetamide CAS Name: 2-[6-methyl-4-oxo-5-[[4-(2-pyrimidinyl)-1-piperazinyl]sulfonyl]-3-thieno[2,3-d]pyrimidinyl]-N-(3,4,5-trimethoxyphenyl)acetamide IUPAC Name: 2-[6-methyl-4-oxo-5-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylthieno[2,3-d]pyrimidin-3-yl]-N-(3,4,5-trimethoxyphenyl)acetamide Traditional Name: 2-[4-keto-6-methyl-5-[4-(2-pyrimidyl)piperazino]sulfonyl-thieno[2,3-d]pyrimidin-3-yl]-N-(3,4,5-trimethoxyphenyl)acetamide Formula: C26H29N7O7S2 MolecularWeight: 615.68116

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H29N7O7S2/c1-16-23(42(36,37)33-10-8-31(9-11-33)26-27-6-5-7-28-26)21-24(41-16)29-15-32(25(21)35)14-20(34)30-17-12-18(38-2)22(40-4)19(13-17)39-3/h5-7,12-13,15H,8-11,14H2,1-4H3,(H,30,34)