2-[2-[2-(3,3-dimethylbutanoylamino)-1,3-thiazol-4-yl]ethanoylamino]-3-methyl-butanoic acid

Systemtic Name: 2-[2-[2-(3,3-dimethylbutanoylamino)-1,3-thiazol-4-yl]ethanoylamino]-3-methyl-butanoic acid Openeye Name: 2-[[2-[2-(3,3-dimethylbutanoylamino)thiazol-4-yl]acetyl]amino]-3-methyl-butanoic acid CAS Name: 2-[[2-[2-[(3,3-dimethyl-1-oxobutyl)amino]-4-thiazolyl]-1-oxoethyl]amino]-3-methylbutanoic acid IUPAC Name: 2-[[2-[2-(3,3-dimethylbutanoylamino)-1,3-thiazol-4-yl]acetyl]amino]-3-methylbutanoic acid Traditional Name: 2-[[2-[2-(3,3-dimethylbutanoylamino)thiazol-4-yl]acetyl]amino]-3-methyl-butyric acid Formula: C16H25N3O4S MolecularWeight: 355.4524

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC(=O)CC1=CSC(=N1)NC(=O)CC(C)(C)C

Isomeric SMILES

CC(C)C(C(=O)O)NC(=O)CC1=CSC(=N1)NC(=O)CC(C)(C)C

InChI

InChI=1S/C16H25N3O4S/c1-9(2)13(14(22)23)18-11(20)6-10-8-24-15(17-10)19-12(21)7-16(3,4)5/h8-9,13H,6-7H2,1-5H3,(H,18,20)(H,22,23)(H,17,19,21)