N-methyl-2-(4-sulfamoylphenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: N-methyl-2-(4-sulfamoylphenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: N-methyl-2-(4-sulfamoylphenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: N-methyl-2-(4-sulfamoylphenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: N-methyl-2-(4-sulfamoylphenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: N-methyl-2-(4-sulfamoylphenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C17H19N3O5S2 MolecularWeight: 409.47986

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1CC2=CC=CC=C2CN1S(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

CNC(=O)C1CC2=CC=CC=C2CN1S(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C17H19N3O5S2/c1-19-17(21)16-10-12-4-2-3-5-13(12)11-20(16)27(24,25)15-8-6-14(7-9-15)26(18,22)23/h2-9,16H,10-11H2,1H3,(H,19,21)(H2,18,22,23)