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

Systemtic Name: 2-tert-butyl-N-[4-(cyanomethoxy)phenyl]-4,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: 2-tert-butyl-N-[4-(cyanomethoxy)phenyl]-4,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: 2-tert-butyl-N-[4-(cyanomethoxy)phenyl]-4,5-dimethyl-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: 2-tert-butyl-N-[4-(cyanomethoxy)phenyl]-4,5-dimethylthieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: 2-tert-butyl-N-[4-(cyanomethoxy)phenyl]-4,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)C)C(C)(C)C)C(=O)NC3=CC=C(C=C3)OCC#N

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)C)C(C)(C)C)C(=O)NC3=CC=C(C=C3)OCC#N

InChI

InChI=1S/C21H22N4O2S/c1-12-16-13(2)23-20(21(3,4)5)25-19(16)28-17(12)18(26)24-14-6-8-15(9-7-14)27-11-10-22/h6-9H,11H2,1-5H3,(H,24,26)