N-[4-(azepan-1-ylcarbonyl)-1,3-thiazol-2-yl]-4-methoxy-benzenesulfonamide

Systemtic Name: N-[4-(azepan-1-ylcarbonyl)-1,3-thiazol-2-yl]-4-methoxy-benzenesulfonamide Openeye Name: N-[4-(azepane-1-carbonyl)thiazol-2-yl]-4-methoxy-benzenesulfonamide CAS Name: N-[4-[1-azepanyl(oxo)methyl]-2-thiazolyl]-4-methoxybenzenesulfonamide IUPAC Name: N-[4-(azepane-1-carbonyl)-1,3-thiazol-2-yl]-4-methoxybenzenesulfonamide Traditional Name: N-[4-(azepane-1-carbonyl)thiazol-2-yl]-4-methoxy-benzenesulfonamide Formula: C17H21N3O4S2 MolecularWeight: 395.49634

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)NC2=NC(=CS2)C(=O)N3CCCCCC3

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)NC2=NC(=CS2)C(=O)N3CCCCCC3

InChI

InChI=1S/C17H21N3O4S2/c1-24-13-6-8-14(9-7-13)26(22,23)19-17-18-15(12-25-17)16(21)20-10-4-2-3-5-11-20/h6-9,12H,2-5,10-11H2,1H3,(H,18,19)