3-(azepan-1-ylsulfonyl)-N-(4,5-dihydro-1,3-thiazol-2-yl)-4-methoxy-benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-(4,5-dihydro-1,3-thiazol-2-yl)-4-methoxy-benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-(4,5-dihydrothiazol-2-yl)-4-methoxy-benzamide CAS Name: 3-(1-azepanylsulfonyl)-N-(4,5-dihydrothiazol-2-yl)-4-methoxybenzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-(4,5-dihydro-1,3-thiazol-2-yl)-4-methoxybenzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-4-methoxy-N-(2-thiazolin-2-yl)benzamide Formula: C17H23N3O4S2 MolecularWeight: 397.51222

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=NCCS2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=NCCS2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C17H23N3O4S2/c1-24-14-7-6-13(16(21)19-17-18-8-11-25-17)12-15(14)26(22,23)20-9-4-2-3-5-10-20/h6-7,12H,2-5,8-11H2,1H3,(H,18,19,21)