N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-(2-ethylbenzimidazol-1-yl)ethanamide

Systemtic Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-(2-ethylbenzimidazol-1-yl)ethanamide Openeye Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-(2-ethylbenzimidazol-1-yl)acetamide CAS Name: N-[5-(1-azepanylsulfonyl)-2-methoxyphenyl]-2-(2-ethyl-1-benzimidazolyl)acetamide IUPAC Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxyphenyl]-2-(2-ethylbenzimidazol-1-yl)acetamide Traditional Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-(2-ethylbenzimidazol-1-yl)acetamide Formula: C24H30N4O4S MolecularWeight: 470.5844

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=CC=CC=C2N1CC(=O)NC3=C(C=CC(=C3)S(=O)(=O)N4CCCCCC4)OC

Isomeric SMILES

CCC1=NC2=CC=CC=C2N1CC(=O)NC3=C(C=CC(=C3)S(=O)(=O)N4CCCCCC4)OC

InChI

InChI=1S/C24H30N4O4S/c1-3-23-25-19-10-6-7-11-21(19)28(23)17-24(29)26-20-16-18(12-13-22(20)32-2)33(30,31)27-14-8-4-5-9-15-27/h6-7,10-13,16H,3-5,8-9,14-15,17H2,1-2H3,(H,26,29)