N-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-2-(2-oxidanylideneazocan-1-yl)ethanamide

Systemtic Name: N-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-2-(2-oxidanylideneazocan-1-yl)ethanamide Openeye Name: N-[4-(3,4-dimethoxyphenyl)thiazol-2-yl]-2-(2-oxoazocan-1-yl)acetamide CAS Name: N-[4-(3,4-dimethoxyphenyl)-2-thiazolyl]-2-(2-oxo-1-azocanyl)acetamide IUPAC Name: N-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-2-(2-oxoazocan-1-yl)acetamide Traditional Name: N-[4-(3,4-dimethoxyphenyl)thiazol-2-yl]-2-(2-ketoazocan-1-yl)acetamide Formula: C20H25N3O4S MolecularWeight: 403.4952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)CN3CCCCCCC3=O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)CN3CCCCCCC3=O)OC

InChI

InChI=1S/C20H25N3O4S/c1-26-16-9-8-14(11-17(16)27-2)15-13-28-20(21-15)22-18(24)12-23-10-6-4-3-5-7-19(23)25/h8-9,11,13H,3-7,10,12H2,1-2H3,(H,21,22,24)