1-azanyl-N-(2,4-dimethoxyphenyl)-5-morpholin-4-yl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinolin-4-ium-2-carboxamide

Systemtic Name: 1-azanyl-N-(2,4-dimethoxyphenyl)-5-morpholin-4-yl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinolin-4-ium-2-carboxamide Openeye Name: 1-amino-N-(2,4-dimethoxyphenyl)-5-morpholino-6,7,8,9-tetrahydrothieno[2,3-c]isoquinolin-4-ium-2-carboxamide CAS Name: 1-amino-N-(2,4-dimethoxyphenyl)-5-(4-morpholinyl)-6,7,8,9-tetrahydrothieno[2,3-c]isoquinolin-4-ium-2-carboxamide IUPAC Name: 1-amino-N-(2,4-dimethoxyphenyl)-5-morpholin-4-yl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinolin-4-ium-2-carboxamide Traditional Name: 1-amino-N-(2,4-dimethoxyphenyl)-5-morpholino-6,7,8,9-tetrahydrothien[2,3-c]isoquinolin-4-ium-2-carboxamide Formula: C24H29N4O4S+ MolecularWeight: 469.57646

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=O)C2=C(C3=C4CCCCC4=C([NH+]=C3S2)N5CCOCC5)N)OC

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=O)C2=C(C3=C4CCCCC4=C([NH+]=C3S2)N5CCOCC5)N)OC

InChI

InChI=1S/C24H28N4O4S/c1-30-14-7-8-17(18(13-14)31-2)26-23(29)21-20(25)19-15-5-3-4-6-16(15)22(27-24(19)33-21)28-9-11-32-12-10-28/h7-8,13H,3-6,9-12,25H2,1-2H3,(H,26,29)/p+1