3-[[5-(dimethylsulfamoyl)-1,3-benzoxazol-2-yl]sulfanyl]-N-[(phenylmethyl)carbamoyl]propanamide

Systemtic Name: 3-[[5-(dimethylsulfamoyl)-1,3-benzoxazol-2-yl]sulfanyl]-N-[(phenylmethyl)carbamoyl]propanamide Openeye Name: N-(benzylcarbamoyl)-3-[[5-(dimethylsulfamoyl)-1,3-benzoxazol-2-yl]sulfanyl]propanamide CAS Name: 3-[[5-(dimethylsulfamoyl)-1,3-benzoxazol-2-yl]thio]-N-[oxo-[(phenylmethyl)amino]methyl]propanamide IUPAC Name: N-(benzylcarbamoyl)-3-[[5-(dimethylsulfamoyl)-1,3-benzoxazol-2-yl]sulfanyl]propanamide Traditional Name: N-(benzylcarbamoyl)-3-[[5-(dimethylsulfamoyl)-1,3-benzoxazol-2-yl]thio]propionamide Formula: C20H22N4O5S2 MolecularWeight: 462.54248

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC2=C(C=C1)OC(=N2)SCCC(=O)NC(=O)NCC3=CC=CC=C3

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC2=C(C=C1)OC(=N2)SCCC(=O)NC(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C20H22N4O5S2/c1-24(2)31(27,28)15-8-9-17-16(12-15)22-20(29-17)30-11-10-18(25)23-19(26)21-13-14-6-4-3-5-7-14/h3-9,12H,10-11,13H2,1-2H3,(H2,21,23,25,26)