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

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-2-[6-methyl-4-oxidanylidene-5-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonyl-thieno[2,3-d]pyrimidin-3-yl]ethanamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-2-[6-methyl-4-oxo-5-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonyl-thieno[2,3-d]pyrimidin-3-yl]acetamide CAS Name: N-(4-bromo-2-methylphenyl)-2-[6-methyl-4-oxo-5-[[4-(2-pyrimidinyl)-1-piperazinyl]sulfonyl]-3-thieno[2,3-d]pyrimidinyl]acetamide IUPAC Name: N-(4-bromo-2-methylphenyl)-2-[6-methyl-4-oxo-5-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylthieno[2,3-d]pyrimidin-3-yl]acetamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-2-[4-keto-6-methyl-5-[4-(2-pyrimidyl)piperazino]sulfonyl-thieno[2,3-d]pyrimidin-3-yl]acetamide Formula: C24H24BrN7O4S2 MolecularWeight: 618.52586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CN2C=NC3=C(C2=O)C(=C(S3)C)S(=O)(=O)N4CCN(CC4)C5=NC=CC=N5

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CN2C=NC3=C(C2=O)C(=C(S3)C)S(=O)(=O)N4CCN(CC4)C5=NC=CC=N5

InChI

InChI=1S/C24H24BrN7O4S2/c1-15-12-17(25)4-5-18(15)29-19(33)13-31-14-28-22-20(23(31)34)21(16(2)37-22)38(35,36)32-10-8-30(9-11-32)24-26-6-3-7-27-24/h3-7,12,14H,8-11,13H2,1-2H3,(H,29,33)