(2R)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(1-methyl-5-sulfamoyl-benzimidazol-2-yl)sulfanyl-propanamide

Systemtic Name: (2R)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(1-methyl-5-sulfamoyl-benzimidazol-2-yl)sulfanyl-propanamide Openeye Name: (2R)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(1-methyl-5-sulfamoyl-benzimidazol-2-yl)sulfanyl-propanamide CAS Name: (2R)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(1-methyl-5-sulfamoyl-2-benzimidazolyl)thio]propanamide IUPAC Name: (2R)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(1-methyl-5-sulfamoylbenzimidazol-2-yl)sulfanylpropanamide Traditional Name: (2R)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(1-methyl-5-sulfamoyl-benzimidazol-2-yl)thio]propionamide Formula: C19H20N4O5S2 MolecularWeight: 448.5159

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC2=C(C=C1)OCCO2)SC3=NC4=C(N3C)C=CC(=C4)S(=O)(=O)N

Isomeric SMILES

C[C@H](C(=O)NC1=CC2=C(C=C1)OCCO2)SC3=NC4=C(N3C)C=CC(=C4)S(=O)(=O)N

InChI

InChI=1S/C19H20N4O5S2/c1-11(18(24)21-12-3-6-16-17(9-12)28-8-7-27-16)29-19-22-14-10-13(30(20,25)26)4-5-15(14)23(19)2/h3-6,9-11H,7-8H2,1-2H3,(H,21,24)(H2,20,25,26)/t11-/m1/s1