3-(azepan-1-ylsulfonyl)-N-(1H-benzimidazol-2-yl)-4-methoxy-benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-(1H-benzimidazol-2-yl)-4-methoxy-benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-(1H-benzimidazol-2-yl)-4-methoxy-benzamide CAS Name: 3-(1-azepanylsulfonyl)-N-(1H-benzimidazol-2-yl)-4-methoxybenzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-(1H-benzimidazol-2-yl)-4-methoxybenzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-(1H-benzimidazol-2-yl)-4-methoxy-benzamide Formula: C21H24N4O4S MolecularWeight: 428.50466

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=NC3=CC=CC=C3N2)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=NC3=CC=CC=C3N2)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C21H24N4O4S/c1-29-18-11-10-15(14-19(18)30(27,28)25-12-6-2-3-7-13-25)20(26)24-21-22-16-8-4-5-9-17(16)23-21/h4-5,8-11,14H,2-3,6-7,12-13H2,1H3,(H2,22,23,24,26)