[2-oxidanylidene-2-(propan-2-ylcarbamoylamino)ethyl] 2-(prop-2-enylamino)-1,3-thiazole-4-carboxylate

Systemtic Name: [2-oxidanylidene-2-(propan-2-ylcarbamoylamino)ethyl] 2-(prop-2-enylamino)-1,3-thiazole-4-carboxylate Openeye Name: [2-(isopropylcarbamoylamino)-2-oxo-ethyl] 2-(allylamino)thiazole-4-carboxylate CAS Name: 2-(prop-2-enylamino)-4-thiazolecarboxylic acid [2-oxo-2-[[oxo-(propan-2-ylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(propan-2-ylcarbamoylamino)ethyl] 2-(prop-2-enylamino)-1,3-thiazole-4-carboxylate Traditional Name: 2-(allylamino)thiazole-4-carboxylic acid [2-(isopropylcarbamoylamino)-2-keto-ethyl] ester Formula: C13H18N4O4S MolecularWeight: 326.37142

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18N4O4S/c1-4-5-14-13-16-9(7-22-13)11(19)21-6-10(18)17-12(20)15-8(2)3/h4,7-8H,1,5-6H2,2-3H3,(H,14,16)(H2,15,17,18,20)