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

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-5-methyl-4-oxidanylidene-3-[2-oxidanylidene-2-(propylamino)ethyl]thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-5-methyl-4-oxo-3-[2-oxo-2-(propylamino)ethyl]thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N-(4-bromo-2-methylphenyl)-5-methyl-4-oxo-3-[2-oxo-2-(propylamino)ethyl]-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N-(4-bromo-2-methylphenyl)-5-methyl-4-oxo-3-[2-oxo-2-(propylamino)ethyl]thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-4-keto-3-[2-keto-2-(propylamino)ethyl]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C20H21BrN4O3S MolecularWeight: 477.37474

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CN1C=NC2=C(C1=O)C(=C(S2)C(=O)NC3=C(C=C(C=C3)Br)C)C

Isomeric SMILES

CCCNC(=O)CN1C=NC2=C(C1=O)C(=C(S2)C(=O)NC3=C(C=C(C=C3)Br)C)C

InChI

InChI=1S/C20H21BrN4O3S/c1-4-7-22-15(26)9-25-10-23-19-16(20(25)28)12(3)17(29-19)18(27)24-14-6-5-13(21)8-11(14)2/h5-6,8,10H,4,7,9H2,1-3H3,(H,22,26)(H,24,27)