3-(1,3-benzoxazol-2-ylsulfanyl)-N-[4-(ethanoylsulfamoyl)phenyl]propanamide

Systemtic Name: 3-(1,3-benzoxazol-2-ylsulfanyl)-N-[4-(ethanoylsulfamoyl)phenyl]propanamide Openeye Name: N-[4-(acetylsulfamoyl)phenyl]-3-(1,3-benzoxazol-2-ylsulfanyl)propanamide CAS Name: N-[4-(acetylsulfamoyl)phenyl]-3-(1,3-benzoxazol-2-ylthio)propanamide IUPAC Name: N-[4-(acetylsulfamoyl)phenyl]-3-(1,3-benzoxazol-2-ylsulfanyl)propanamide Traditional Name: N-[4-(acetylsulfamoyl)phenyl]-3-(1,3-benzoxazol-2-ylthio)propionamide Formula: C18H17N3O5S2 MolecularWeight: 419.47468

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NS(=O)(=O)C1=CC=C(C=C1)NC(=O)CCSC2=NC3=CC=CC=C3O2

Isomeric SMILES

CC(=O)NS(=O)(=O)C1=CC=C(C=C1)NC(=O)CCSC2=NC3=CC=CC=C3O2

InChI

InChI=1S/C18H17N3O5S2/c1-12(22)21-28(24,25)14-8-6-13(7-9-14)19-17(23)10-11-27-18-20-15-4-2-3-5-16(15)26-18/h2-9H,10-11H2,1H3,(H,19,23)(H,21,22)