N-(4-bromanyl-2-methyl-phenyl)-5-methyl-4-oxidanylidene-3-(2-oxidanylidene-2-pyrrolidin-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-pyrrolidin-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-pyrrolidin-1-yl-ethyl)thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N-(4-bromo-2-methylphenyl)-5-methyl-4-oxo-3-[2-oxo-2-(1-pyrrolidinyl)ethyl]-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N-(4-bromo-2-methylphenyl)-5-methyl-4-oxo-3-(2-oxo-2-pyrrolidin-1-ylethyl)thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-4-keto-3-(2-keto-2-pyrrolidino-ethyl)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C21H21BrN4O3S MolecularWeight: 489.38544

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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)N4CCCC4)C

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)C2=C(C3=C(S2)N=CN(C3=O)CC(=O)N4CCCC4)C

InChI

InChI=1S/C21H21BrN4O3S/c1-12-9-14(22)5-6-15(12)24-19(28)18-13(2)17-20(30-18)23-11-26(21(17)29)10-16(27)25-7-3-4-8-25/h5-6,9,11H,3-4,7-8,10H2,1-2H3,(H,24,28)