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

Systemtic Name: N-[3-(tert-butylcarbamoylamino)propyl]-2-[(3,5-dimethylphenoxy)methyl]-1,3-thiazole-4-carboxamide Openeye Name: N-[3-(tert-butylcarbamoylamino)propyl]-2-[(3,5-dimethylphenoxy)methyl]thiazole-4-carboxamide CAS Name: N-[3-[[(tert-butylamino)-oxomethyl]amino]propyl]-2-[(3,5-dimethylphenoxy)methyl]-4-thiazolecarboxamide IUPAC Name: N-[3-(tert-butylcarbamoylamino)propyl]-2-[(3,5-dimethylphenoxy)methyl]-1,3-thiazole-4-carboxamide Traditional Name: N-[3-(tert-butylcarbamoylamino)propyl]-2-[(3,5-dimethylphenoxy)methyl]thiazole-4-carboxamide Formula: C21H30N4O3S MolecularWeight: 418.5529

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H30N4O3S/c1-14-9-15(2)11-16(10-14)28-12-18-24-17(13-29-18)19(26)22-7-6-8-23-20(27)25-21(3,4)5/h9-11,13H,6-8,12H2,1-5H3,(H,22,26)(H2,23,25,27)