N-(4-bromanyl-2-methyl-phenyl)-5-methyl-4-oxidanylidene-3-(2-oxidanylidene-2-piperidin-1-yl-ethyl)thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-5-methyl-4-oxidanylidene-3-(2-oxidanylidene-2-piperidin-1-yl-ethyl)thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-5-methyl-4-oxo-3-[2-oxo-2-(1-piperidyl)ethyl]thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N-(4-bromo-2-methylphenyl)-5-methyl-4-oxo-3-[2-oxo-2-(1-piperidinyl)ethyl]-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N-(4-bromo-2-methylphenyl)-5-methyl-4-oxo-3-(2-oxo-2-piperidin-1-ylethyl)thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-4-keto-3-(2-keto-2-piperidino-ethyl)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C22H23BrN4O3S MolecularWeight: 503.41202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)C2=C(C3=C(S2)N=CN(C3=O)CC(=O)N4CCCCC4)C

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)C2=C(C3=C(S2)N=CN(C3=O)CC(=O)N4CCCCC4)C

InChI

InChI=1S/C22H23BrN4O3S/c1-13-10-15(23)6-7-16(13)25-20(29)19-14(2)18-21(31-19)24-12-27(22(18)30)11-17(28)26-8-4-3-5-9-26/h6-7,10,12H,3-5,8-9,11H2,1-2H3,(H,25,29)