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

Systemtic Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-imidazol-1-yl-ethanamide Openeye Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-imidazol-1-yl-acetamide CAS Name: N-[5-(1-azepanylsulfonyl)-2-methoxyphenyl]-2-(1-imidazolyl)acetamide IUPAC Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxyphenyl]-2-imidazol-1-ylacetamide Traditional Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-imidazol-1-yl-acetamide Formula: C18H24N4O4S MolecularWeight: 392.47256

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)NC(=O)CN3C=CN=C3

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)NC(=O)CN3C=CN=C3

InChI

InChI=1S/C18H24N4O4S/c1-26-17-7-6-15(27(24,25)22-9-4-2-3-5-10-22)12-16(17)20-18(23)13-21-11-8-19-14-21/h6-8,11-12,14H,2-5,9-10,13H2,1H3,(H,20,23)