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

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-2-[6-methyl-5-(4-methylpiperidin-1-yl)sulfonyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]ethanamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-2-[6-methyl-5-[(4-methyl-1-piperidyl)sulfonyl]-4-oxo-thieno[2,3-d]pyrimidin-3-yl]acetamide CAS Name: N-(4-bromo-2-methylphenyl)-2-[6-methyl-5-[(4-methyl-1-piperidinyl)sulfonyl]-4-oxo-3-thieno[2,3-d]pyrimidinyl]acetamide IUPAC Name: N-(4-bromo-2-methylphenyl)-2-[6-methyl-5-(4-methylpiperidin-1-yl)sulfonyl-4-oxothieno[2,3-d]pyrimidin-3-yl]acetamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-2-[4-keto-6-methyl-5-(4-methylpiperidino)sulfonyl-thieno[2,3-d]pyrimidin-3-yl]acetamide Formula: C22H25BrN4O4S2 MolecularWeight: 553.4923

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=C(SC3=C2C(=O)N(C=N3)CC(=O)NC4=C(C=C(C=C4)Br)C)C

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=C(SC3=C2C(=O)N(C=N3)CC(=O)NC4=C(C=C(C=C4)Br)C)C

InChI

InChI=1S/C22H25BrN4O4S2/c1-13-6-8-27(9-7-13)33(30,31)20-15(3)32-21-19(20)22(29)26(12-24-21)11-18(28)25-17-5-4-16(23)10-14(17)2/h4-5,10,12-13H,6-9,11H2,1-3H3,(H,25,28)