2-tert-butyl-4,5-dimethyl-N-(4-oxidanylidenequinazolin-3-yl)thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: 2-tert-butyl-4,5-dimethyl-N-(4-oxidanylidenequinazolin-3-yl)thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: 2-tert-butyl-4,5-dimethyl-N-(4-oxoquinazolin-3-yl)thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: 2-tert-butyl-4,5-dimethyl-N-(4-oxo-3-quinazolinyl)-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: 2-tert-butyl-4,5-dimethyl-N-(4-oxoquinazolin-3-yl)thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: 2-tert-butyl-N-(4-ketoquinazolin-3-yl)-4,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C21H21N5O2S MolecularWeight: 407.48874

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)C)C(C)(C)C)C(=O)NN3C=NC4=CC=CC=C4C3=O

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)C)C(C)(C)C)C(=O)NN3C=NC4=CC=CC=C4C3=O

InChI

InChI=1S/C21H21N5O2S/c1-11-15-12(2)23-20(21(3,4)5)24-18(15)29-16(11)17(27)25-26-10-22-14-9-7-6-8-13(14)19(26)28/h6-10H,1-5H3,(H,25,27)