4-(3,4-dihydro-1H-isoquinolin-2-yl)-5-methyl-N-(5-methyl-1,2-oxazol-3-yl)thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: 4-(3,4-dihydro-1H-isoquinolin-2-yl)-5-methyl-N-(5-methyl-1,2-oxazol-3-yl)thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: 4-(3,4-dihydro-1H-isoquinolin-2-yl)-5-methyl-N-(5-methylisoxazol-3-yl)thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: 4-(3,4-dihydro-1H-isoquinolin-2-yl)-5-methyl-N-(5-methyl-3-isoxazolyl)-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: 4-(3,4-dihydro-1H-isoquinolin-2-yl)-5-methyl-N-(5-methyl-1,2-oxazol-3-yl)thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: 4-(3,4-dihydro-1H-isoquinolin-2-yl)-5-methyl-N-(5-methylisoxazol-3-yl)thieno[2,3-d]pyrimidine-6-carboxamide Formula: C21H19N5O2S MolecularWeight: 405.47286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)C2=C(C3=C(N=CN=C3S2)N4CCC5=CC=CC=C5C4)C

Isomeric SMILES

CC1=CC(=NO1)NC(=O)C2=C(C3=C(N=CN=C3S2)N4CCC5=CC=CC=C5C4)C

InChI

InChI=1S/C21H19N5O2S/c1-12-9-16(25-28-12)24-20(27)18-13(2)17-19(22-11-23-21(17)29-18)26-8-7-14-5-3-4-6-15(14)10-26/h3-6,9,11H,7-8,10H2,1-2H3,(H,24,25,27)