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

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-4-(3,4-dihydro-1H-isoquinolin-2-yl)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-4-(3,4-dihydro-1H-isoquinolin-2-yl)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N-(4-bromo-2-methylphenyl)-4-(3,4-dihydro-1H-isoquinolin-2-yl)-5-methyl-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N-(4-bromo-2-methylphenyl)-4-(3,4-dihydro-1H-isoquinolin-2-yl)-5-methylthieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-4-(3,4-dihydro-1H-isoquinolin-2-yl)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C24H21BrN4OS MolecularWeight: 493.41874

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)C2=C(C3=C(N=CN=C3S2)N4CCC5=CC=CC=C5C4)C

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)C2=C(C3=C(N=CN=C3S2)N4CCC5=CC=CC=C5C4)C

InChI

InChI=1S/C24H21BrN4OS/c1-14-11-18(25)7-8-19(14)28-23(30)21-15(2)20-22(26-13-27-24(20)31-21)29-10-9-16-5-3-4-6-17(16)12-29/h3-8,11,13H,9-10,12H2,1-2H3,(H,28,30)