2-[4-[4-(furan-2-ylmethylsulfamoyl)phenyl]carbonyl-1,4-diazepan-1-yl]-N,N-dimethyl-ethanamide

Systemtic Name: 2-[4-[4-(furan-2-ylmethylsulfamoyl)phenyl]carbonyl-1,4-diazepan-1-yl]-N,N-dimethyl-ethanamide Openeye Name: 2-[4-[4-(2-furylmethylsulfamoyl)benzoyl]-1,4-diazepan-1-yl]-N,N-dimethyl-acetamide CAS Name: 2-[4-[[4-(2-furanylmethylsulfamoyl)phenyl]-oxomethyl]-1,4-diazepan-1-yl]-N,N-dimethylacetamide IUPAC Name: 2-[4-[4-(furan-2-ylmethylsulfamoyl)benzoyl]-1,4-diazepan-1-yl]-N,N-dimethylacetamide Traditional Name: 2-[4-[4-(2-furfurylsulfamoyl)benzoyl]-1,4-diazepan-1-yl]-N,N-dimethyl-acetamide Formula: C21H28N4O5S MolecularWeight: 448.53582

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)CN1CCCN(CC1)C(=O)C2=CC=C(C=C2)S(=O)(=O)NCC3=CC=CO3

Isomeric SMILES

CN(C)C(=O)CN1CCCN(CC1)C(=O)C2=CC=C(C=C2)S(=O)(=O)NCC3=CC=CO3

InChI

InChI=1S/C21H28N4O5S/c1-23(2)20(26)16-24-10-4-11-25(13-12-24)21(27)17-6-8-19(9-7-17)31(28,29)22-15-18-5-3-14-30-18/h3,5-9,14,22H,4,10-13,15-16H2,1-2H3