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

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-(2-oxidanylidene-1,3-thiazolidin-3-yl)ethanamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-(2-oxothiazolidin-3-yl)acetamide CAS Name: N-[3-(1-azepanylsulfonyl)-4-methylphenyl]-2-(2-oxo-3-thiazolidinyl)acetamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)-4-methylphenyl]-2-(2-oxo-1,3-thiazolidin-3-yl)acetamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-(2-ketothiazolidin-3-yl)acetamide Formula: C18H25N3O4S2 MolecularWeight: 411.5388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CN2CCSC2=O)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CN2CCSC2=O)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C18H25N3O4S2/c1-14-6-7-15(19-17(22)13-20-10-11-26-18(20)23)12-16(14)27(24,25)21-8-4-2-3-5-9-21/h6-7,12H,2-5,8-11,13H2,1H3,(H,19,22)