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

Systemtic Name: 4-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-methoxy-5-nitro-phenyl)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: 4-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-methoxy-5-nitro-phenyl)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: 4-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-methoxy-5-nitrophenyl)-5-methyl-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: 4-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-methoxy-5-nitrophenyl)-5-methylthieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: 4-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-methoxy-5-nitro-phenyl)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C24H21N5O4S MolecularWeight: 475.51964

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)N3CCC4=CC=CC=C4C3)C(=O)NC5=C(C=CC(=C5)[N+](=O)[O-])OC

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)N3CCC4=CC=CC=C4C3)C(=O)NC5=C(C=CC(=C5)[N+](=O)[O-])OC

InChI

InChI=1S/C24H21N5O4S/c1-14-20-22(28-10-9-15-5-3-4-6-16(15)12-28)25-13-26-24(20)34-21(14)23(30)27-18-11-17(29(31)32)7-8-19(18)33-2/h3-8,11,13H,9-10,12H2,1-2H3,(H,27,30)