5-chloranyl-N-[4-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)carbonyl]phenyl]thiophene-2-sulfonamide

Systemtic Name: 5-chloranyl-N-[4-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)carbonyl]phenyl]thiophene-2-sulfonamide Openeye Name: 5-chloro-N-[4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)phenyl]thiophene-2-sulfonamide CAS Name: 5-chloro-N-[4-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-oxomethyl]phenyl]-2-thiophenesulfonamide IUPAC Name: 5-chloro-N-[4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)phenyl]thiophene-2-sulfonamide Traditional Name: 5-chloro-N-[4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)phenyl]thiophene-2-sulfonamide Formula: C22H21ClN2O5S2 MolecularWeight: 492.99554

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)C(=O)C3=CC=C(C=C3)NS(=O)(=O)C4=CC=C(S4)Cl)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)C(=O)C3=CC=C(C=C3)NS(=O)(=O)C4=CC=C(S4)Cl)OC

InChI

InChI=1S/C22H21ClN2O5S2/c1-29-18-11-15-9-10-25(13-16(15)12-19(18)30-2)22(26)14-3-5-17(6-4-14)24-32(27,28)21-8-7-20(23)31-21/h3-8,11-12,24H,9-10,13H2,1-2H3