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

Systemtic Name: 1-azanyl-5-morpholin-4-yl-N-(phenylmethyl)-6,7,8,9-tetrahydrothieno[2,3-c]isoquinolin-4-ium-2-carboxamide Openeye Name: 1-amino-N-benzyl-5-morpholino-6,7,8,9-tetrahydrothieno[2,3-c]isoquinolin-4-ium-2-carboxamide CAS Name: 1-amino-5-(4-morpholinyl)-N-(phenylmethyl)-6,7,8,9-tetrahydrothieno[2,3-c]isoquinolin-4-ium-2-carboxamide IUPAC Name: 1-amino-N-benzyl-5-morpholin-4-yl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinolin-4-ium-2-carboxamide Traditional Name: 1-amino-N-benzyl-5-morpholino-6,7,8,9-tetrahydrothien[2,3-c]isoquinolin-4-ium-2-carboxamide Formula: C23H27N4O2S+ MolecularWeight: 423.55108

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C([NH+]=C3C(=C2C1)C(=C(S3)C(=O)NCC4=CC=CC=C4)N)N5CCOCC5

Isomeric SMILES

C1CCC2=C([NH+]=C3C(=C2C1)C(=C(S3)C(=O)NCC4=CC=CC=C4)N)N5CCOCC5

InChI

InChI=1S/C23H26N4O2S/c24-19-18-16-8-4-5-9-17(16)21(27-10-12-29-13-11-27)26-23(18)30-20(19)22(28)25-14-15-6-2-1-3-7-15/h1-3,6-7H,4-5,8-14,24H2,(H,25,28)/p+1