5-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]thiophene-2-sulfonamide

Systemtic Name: 5-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]thiophene-2-sulfonamide Openeye Name: 5-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]thiophene-2-sulfonamide CAS Name: 5-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-2-thiophenesulfonamide IUPAC Name: 5-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]thiophene-2-sulfonamide Traditional Name: 5-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethyl]thiophene-2-sulfonamide Formula: C17H20N2O5S2 MolecularWeight: 396.4811

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)C(=O)CC3=CC=C(S3)S(=O)(=O)N)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)C(=O)CC3=CC=C(S3)S(=O)(=O)N)OC

InChI

InChI=1S/C17H20N2O5S2/c1-23-14-7-11-5-6-19(10-12(11)8-15(14)24-2)16(20)9-13-3-4-17(25-13)26(18,21)22/h3-4,7-8H,5-6,9-10H2,1-2H3,(H2,18,21,22)