2-[6-methyl-4-oxidanylidene-5-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonyl-thieno[2,3-d]pyrimidin-3-yl]-N-[3-(trifluoromethyl)phenyl]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-(trifluoromethyl)phenyl]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-(trifluoromethyl)phenyl]acetamide CAS Name: 2-[6-methyl-4-oxo-5-[[4-(2-pyrimidinyl)-1-piperazinyl]sulfonyl]-3-thieno[2,3-d]pyrimidinyl]-N-[3-(trifluoromethyl)phenyl]acetamide IUPAC Name: 2-[6-methyl-4-oxo-5-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylthieno[2,3-d]pyrimidin-3-yl]-N-[3-(trifluoromethyl)phenyl]acetamide Traditional Name: 2-[4-keto-6-methyl-5-[4-(2-pyrimidyl)piperazino]sulfonyl-thieno[2,3-d]pyrimidin-3-yl]-N-[3-(trifluoromethyl)phenyl]acetamide Formula: C24H22F3N7O4S2 MolecularWeight: 593.60119

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H22F3N7O4S2/c1-15-20(40(37,38)34-10-8-32(9-11-34)23-28-6-3-7-29-23)19-21(39-15)30-14-33(22(19)36)13-18(35)31-17-5-2-4-16(12-17)24(25,26)27/h2-7,12,14H,8-11,13H2,1H3,(H,31,35)