N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-(4-methyl-2-oxidanylidene-1,3-thiazol-3-yl)ethanamide

Systemtic Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-(4-methyl-2-oxidanylidene-1,3-thiazol-3-yl)ethanamide Openeye Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-(4-methyl-2-oxo-thiazol-3-yl)acetamide CAS Name: N-[5-(1-azepanylsulfonyl)-2-methoxyphenyl]-2-(4-methyl-2-oxo-3-thiazolyl)acetamide IUPAC Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxyphenyl]-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide Traditional Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-(2-keto-4-methyl-4-thiazolin-3-yl)acetamide Formula: C19H25N3O5S2 MolecularWeight: 439.5489

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=O)N1CC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCCC3)OC

Isomeric SMILES

CC1=CSC(=O)N1CC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCCC3)OC

InChI

InChI=1S/C19H25N3O5S2/c1-14-13-28-19(24)22(14)12-18(23)20-16-11-15(7-8-17(16)27-2)29(25,26)21-9-5-3-4-6-10-21/h7-8,11,13H,3-6,9-10,12H2,1-2H3,(H,20,23)