3-(azepan-1-ylsulfonyl)-4-methoxy-N-(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-methoxy-N-(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-4-methoxy-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)benzamide CAS Name: 3-(1-azepanylsulfonyl)-4-methoxy-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-methoxy-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-(2-keto-1,3-dihydrobenzimidazol-5-yl)-4-methoxy-benzamide Formula: C21H24N4O5S MolecularWeight: 444.50406

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=CC3=C(C=C2)NC(=O)N3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=CC3=C(C=C2)NC(=O)N3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C21H24N4O5S/c1-30-18-9-6-14(12-19(18)31(28,29)25-10-4-2-3-5-11-25)20(26)22-15-7-8-16-17(13-15)24-21(27)23-16/h6-9,12-13H,2-5,10-11H2,1H3,(H,22,26)(H2,23,24,27)