N-[3-(azepan-1-ylsulfonyl)phenyl]-2-(3-ethyl-2-oxidanylidene-benzimidazol-1-yl)ethanamide

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-(3-ethyl-2-oxidanylidene-benzimidazol-1-yl)ethanamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-(3-ethyl-2-oxo-benzimidazol-1-yl)acetamide CAS Name: N-[3-(1-azepanylsulfonyl)phenyl]-2-(3-ethyl-2-oxo-1-benzimidazolyl)acetamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-(3-ethyl-2-oxobenzimidazol-1-yl)acetamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-(3-ethyl-2-keto-benzimidazol-1-yl)acetamide Formula: C23H28N4O4S MolecularWeight: 456.55782

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N(C1=O)CC(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CCN1C2=CC=CC=C2N(C1=O)CC(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C23H28N4O4S/c1-2-26-20-12-5-6-13-21(20)27(23(26)29)17-22(28)24-18-10-9-11-19(16-18)32(30,31)25-14-7-3-4-8-15-25/h5-6,9-13,16H,2-4,7-8,14-15,17H2,1H3,(H,24,28)