2-[6-(azepan-1-ylsulfonyl)-2-oxidanylidene-1,3-benzoxazol-3-yl]-N-[(2-chlorophenyl)methyl]ethanamide

Systemtic Name: 2-[6-(azepan-1-ylsulfonyl)-2-oxidanylidene-1,3-benzoxazol-3-yl]-N-[(2-chlorophenyl)methyl]ethanamide Openeye Name: 2-[6-(azepan-1-ylsulfonyl)-2-oxo-1,3-benzoxazol-3-yl]-N-[(2-chlorophenyl)methyl]acetamide CAS Name: 2-[6-(1-azepanylsulfonyl)-2-oxo-1,3-benzoxazol-3-yl]-N-[(2-chlorophenyl)methyl]acetamide IUPAC Name: 2-[6-(azepan-1-ylsulfonyl)-2-oxo-1,3-benzoxazol-3-yl]-N-[(2-chlorophenyl)methyl]acetamide Traditional Name: 2-[6-(azepan-1-ylsulfonyl)-2-keto-1,3-benzoxazol-3-yl]-N-(2-chlorobenzyl)acetamide Formula: C22H24ClN3O5S MolecularWeight: 477.96106

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)O3)CC(=O)NCC4=CC=CC=C4Cl

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)O3)CC(=O)NCC4=CC=CC=C4Cl

InChI

InChI=1S/C22H24ClN3O5S/c23-18-8-4-3-7-16(18)14-24-21(27)15-26-19-10-9-17(13-20(19)31-22(26)28)32(29,30)25-11-5-1-2-6-12-25/h3-4,7-10,13H,1-2,5-6,11-12,14-15H2,(H,24,27)