2-cyclopropyl-4,5-dimethyl-N-[3-(2-pyridin-2-ylethynyl)phenyl]thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: 2-cyclopropyl-4,5-dimethyl-N-[3-(2-pyridin-2-ylethynyl)phenyl]thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: 2-cyclopropyl-4,5-dimethyl-N-[3-[2-(2-pyridyl)ethynyl]phenyl]thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: 2-cyclopropyl-4,5-dimethyl-N-[3-[2-(2-pyridinyl)ethynyl]phenyl]-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: 2-cyclopropyl-4,5-dimethyl-N-[3-(2-pyridin-2-ylethynyl)phenyl]thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: 2-cyclopropyl-4,5-dimethyl-N-[3-[2-(2-pyridyl)ethynyl]phenyl]thieno[2,3-d]pyrimidine-6-carboxamide Formula: C25H20N4OS MolecularWeight: 424.5175

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)C)C3CC3)C(=O)NC4=CC=CC(=C4)C#CC5=CC=CC=N5

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)C)C3CC3)C(=O)NC4=CC=CC(=C4)C#CC5=CC=CC=N5

InChI

InChI=1S/C25H20N4OS/c1-15-21-16(2)27-23(18-10-11-18)29-25(21)31-22(15)24(30)28-20-8-5-6-17(14-20)9-12-19-7-3-4-13-26-19/h3-8,13-14,18H,10-11H2,1-2H3,(H,28,30)