N-[2-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-1H-indol-7-yl]-4-methoxy-benzenesulfonamide

Systemtic Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-1H-indol-7-yl]-4-methoxy-benzenesulfonamide Openeye Name: N-[2-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-1H-indol-7-yl]-4-methoxy-benzenesulfonamide CAS Name: N-[2-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-1H-indol-7-yl]-4-methoxybenzenesulfonamide IUPAC Name: N-[2-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-1H-indol-7-yl]-4-methoxybenzenesulfonamide Traditional Name: N-[2-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-1H-indol-7-yl]-4-methoxy-benzenesulfonamide Formula: C25H23N3O4S MolecularWeight: 461.53282

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC3=C2NC(=C3)C(=O)N4CCC5=CC=CC=C5C4

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC3=C2NC(=C3)C(=O)N4CCC5=CC=CC=C5C4

InChI

InChI=1S/C25H23N3O4S/c1-32-20-9-11-21(12-10-20)33(30,31)27-22-8-4-7-18-15-23(26-24(18)22)25(29)28-14-13-17-5-2-3-6-19(17)16-28/h2-12,15,26-27H,13-14,16H2,1H3