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

Systemtic Name: 2-[6-methyl-4-oxidanylidene-5-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonyl-thieno[2,3-d]pyrimidin-3-yl]-N-(4-phenoxyphenyl)ethanamide Openeye Name: 2-[6-methyl-4-oxo-5-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonyl-thieno[2,3-d]pyrimidin-3-yl]-N-(4-phenoxyphenyl)acetamide CAS Name: 2-[6-methyl-4-oxo-5-[[4-(2-pyrimidinyl)-1-piperazinyl]sulfonyl]-3-thieno[2,3-d]pyrimidinyl]-N-(4-phenoxyphenyl)acetamide IUPAC Name: 2-[6-methyl-4-oxo-5-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylthieno[2,3-d]pyrimidin-3-yl]-N-(4-phenoxyphenyl)acetamide Traditional Name: 2-[4-keto-6-methyl-5-[4-(2-pyrimidyl)piperazino]sulfonyl-thieno[2,3-d]pyrimidin-3-yl]-N-(4-phenoxyphenyl)acetamide Formula: C29H27N7O5S2 MolecularWeight: 617.69858

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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)OC4=CC=CC=C4)S(=O)(=O)N5CCN(CC5)C6=NC=CC=N6

Isomeric SMILES

CC1=C(C2=C(S1)N=CN(C2=O)CC(=O)NC3=CC=C(C=C3)OC4=CC=CC=C4)S(=O)(=O)N5CCN(CC5)C6=NC=CC=N6

InChI

InChI=1S/C29H27N7O5S2/c1-20-26(43(39,40)36-16-14-34(15-17-36)29-30-12-5-13-31-29)25-27(42-20)32-19-35(28(25)38)18-24(37)33-21-8-10-23(11-9-21)41-22-6-3-2-4-7-22/h2-13,19H,14-18H2,1H3,(H,33,37)