ethyl 2-[[2-(3-methylbutanoylamino)-1,3-thiazol-4-yl]carbonylamino]ethanoate

Systemtic Name: ethyl 2-[[2-(3-methylbutanoylamino)-1,3-thiazol-4-yl]carbonylamino]ethanoate Openeye Name: ethyl 2-[[2-(3-methylbutanoylamino)thiazole-4-carbonyl]amino]acetate CAS Name: 2-[[[2-[(3-methyl-1-oxobutyl)amino]-4-thiazolyl]-oxomethyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[2-(3-methylbutanoylamino)-1,3-thiazole-4-carbonyl]amino]acetate Traditional Name: 2-[[2-(isovalerylamino)thiazole-4-carbonyl]amino]acetic acid ethyl ester Formula: C13H19N3O4S MolecularWeight: 313.37266

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC(=O)C1=CSC(=N1)NC(=O)CC(C)C

Isomeric SMILES

CCOC(=O)CNC(=O)C1=CSC(=N1)NC(=O)CC(C)C

InChI

InChI=1S/C13H19N3O4S/c1-4-20-11(18)6-14-12(19)9-7-21-13(15-9)16-10(17)5-8(2)3/h7-8H,4-6H2,1-3H3,(H,14,19)(H,15,16,17)