(3,3-dimethyl-2-oxidanylidene-butyl) 2-(prop-2-enylamino)-1,3-thiazole-4-carboxylate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 2-(prop-2-enylamino)-1,3-thiazole-4-carboxylate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 2-(allylamino)thiazole-4-carboxylate CAS Name: 2-(prop-2-enylamino)-4-thiazolecarboxylic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 2-(prop-2-enylamino)-1,3-thiazole-4-carboxylate Traditional Name: 2-(allylamino)thiazole-4-carboxylic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C13H18N2O3S MolecularWeight: 282.35862

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)COC(=O)C1=CSC(=N1)NCC=C

Isomeric SMILES

CC(C)(C)C(=O)COC(=O)C1=CSC(=N1)NCC=C

InChI

InChI=1S/C13H18N2O3S/c1-5-6-14-12-15-9(8-19-12)11(17)18-7-10(16)13(2,3)4/h5,8H,1,6-7H2,2-4H3,(H,14,15)