(3R)-2-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: (3R)-2-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: (3R)-2-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: (3R)-2-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: (3R)-2-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: (3R)-N-methyl-2-piazthiol-4-ylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C17H16N4O3S2 MolecularWeight: 388.46394

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1CC2=CC=CC=C2CN1S(=O)(=O)C3=CC=CC4=NSN=C43

Isomeric SMILES

CNC(=O)[C@H]1CC2=CC=CC=C2CN1S(=O)(=O)C3=CC=CC4=NSN=C43

InChI

InChI=1S/C17H16N4O3S2/c1-18-17(22)14-9-11-5-2-3-6-12(11)10-21(14)26(23,24)15-8-4-7-13-16(15)20-25-19-13/h2-8,14H,9-10H2,1H3,(H,18,22)/t14-/m1/s1