1-oxidanylidene-N-(4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)-2H-isoquinoline-3-carboxamide

Systemtic Name: 1-oxidanylidene-N-(4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)-2H-isoquinoline-3-carboxamide Openeye Name: 1-oxo-N-(4-oxo-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)-2H-isoquinoline-3-carboxamide CAS Name: 1-oxo-N-(4-oxo-5-phenyl-3-thieno[2,3-d]pyrimidinyl)-2H-isoquinoline-3-carboxamide IUPAC Name: 1-oxo-N-(4-oxo-5-phenylthieno[2,3-d]pyrimidin-3-yl)-2H-isoquinoline-3-carboxamide Traditional Name: 1-keto-N-(4-keto-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)-2H-isoquinoline-3-carboxamide Formula: C22H14N4O3S MolecularWeight: 414.43656

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C=N3)NC(=O)C4=CC5=CC=CC=C5C(=O)N4

Isomeric SMILES

C1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C=N3)NC(=O)C4=CC5=CC=CC=C5C(=O)N4

InChI

InChI=1S/C22H14N4O3S/c27-19-15-9-5-4-8-14(15)10-17(24-19)20(28)25-26-12-23-21-18(22(26)29)16(11-30-21)13-6-2-1-3-7-13/h1-12H,(H,24,27)(H,25,28)