4-[(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)carbonyl]-N-prop-2-enyl-benzenesulfonamide

Systemtic Name: 4-[(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)carbonyl]-N-prop-2-enyl-benzenesulfonamide Openeye Name: N-allyl-4-[6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinoline-2-carbonyl]benzenesulfonamide CAS Name: 4-[(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)-oxomethyl]-N-prop-2-enylbenzenesulfonamide IUPAC Name: 4-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinoline-2-carbonyl)-N-prop-2-enylbenzenesulfonamide Traditional Name: N-allyl-4-[6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinoline-2-carbonyl]benzenesulfonamide Formula: C25H26N2O5S2 MolecularWeight: 498.61434

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(CCC2=C1)C(=O)C3=CC=C(C=C3)S(=O)(=O)NCC=C)C4=CC=CS4)OC

Isomeric SMILES

COC1=C(C=C2C(N(CCC2=C1)C(=O)C3=CC=C(C=C3)S(=O)(=O)NCC=C)C4=CC=CS4)OC

InChI

InChI=1S/C25H26N2O5S2/c1-4-12-26-34(29,30)19-9-7-17(8-10-19)25(28)27-13-11-18-15-21(31-2)22(32-3)16-20(18)24(27)23-6-5-14-33-23/h4-10,14-16,24,26H,1,11-13H2,2-3H3