N-(2-propylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)quinoline-8-sulfonamide

Systemtic Name: N-(2-propylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)quinoline-8-sulfonamide Openeye Name: N-(2-propylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)quinoline-8-sulfonamide CAS Name: N-(2-propylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)-8-quinolinesulfonamide IUPAC Name: N-(2-propylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)quinoline-8-sulfonamide Traditional Name: N-(2-propylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)quinoline-8-sulfonamide Formula: C21H23N3O4S2 MolecularWeight: 445.55502

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1CCC2=C(C1)C=C(C=C2)NS(=O)(=O)C3=CC=CC4=C3N=CC=C4

Isomeric SMILES

CCCS(=O)(=O)N1CCC2=C(C1)C=C(C=C2)NS(=O)(=O)C3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C21H23N3O4S2/c1-2-13-29(25,26)24-12-10-16-8-9-19(14-18(16)15-24)23-30(27,28)20-7-3-5-17-6-4-11-22-21(17)20/h3-9,11,14,23H,2,10,12-13,15H2,1H3