2-[(3,5-dimethylphenoxy)methyl]-N-[3-(2-thiophen-2-ylethanoylamino)propyl]-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[(3,5-dimethylphenoxy)methyl]-N-[3-(2-thiophen-2-ylethanoylamino)propyl]-1,3-thiazole-4-carboxamide Openeye Name: 2-[(3,5-dimethylphenoxy)methyl]-N-[3-[[2-(2-thienyl)acetyl]amino]propyl]thiazole-4-carboxamide CAS Name: 2-[(3,5-dimethylphenoxy)methyl]-N-[3-[(1-oxo-2-thiophen-2-ylethyl)amino]propyl]-4-thiazolecarboxamide IUPAC Name: 2-[(3,5-dimethylphenoxy)methyl]-N-[3-[(2-thiophen-2-ylacetyl)amino]propyl]-1,3-thiazole-4-carboxamide Traditional Name: 2-[(3,5-dimethylphenoxy)methyl]-N-[3-[[2-(2-thienyl)acetyl]amino]propyl]thiazole-4-carboxamide Formula: C22H25N3O3S2 MolecularWeight: 443.5822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCC2=NC(=CS2)C(=O)NCCCNC(=O)CC3=CC=CS3)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCC2=NC(=CS2)C(=O)NCCCNC(=O)CC3=CC=CS3)C

InChI

InChI=1S/C22H25N3O3S2/c1-15-9-16(2)11-17(10-15)28-13-21-25-19(14-30-21)22(27)24-7-4-6-23-20(26)12-18-5-3-8-29-18/h3,5,8-11,14H,4,6-7,12-13H2,1-2H3,(H,23,26)(H,24,27)