(2S)-3-methyl-2-[3-(2-propan-2-yl-1,3-thiazol-4-yl)propanoylamino]butanoic acid

Systemtic Name: (2S)-3-methyl-2-[3-(2-propan-2-yl-1,3-thiazol-4-yl)propanoylamino]butanoic acid Openeye Name: (2S)-2-[3-(2-isopropylthiazol-4-yl)propanoylamino]-3-methyl-butanoic acid CAS Name: (2S)-3-methyl-2-[[1-oxo-3-(2-propan-2-yl-4-thiazolyl)propyl]amino]butanoic acid IUPAC Name: (2S)-3-methyl-2-[3-(2-propan-2-yl-1,3-thiazol-4-yl)propanoylamino]butanoic acid Traditional Name: (2S)-2-[3-(2-isopropylthiazol-4-yl)propanoylamino]-3-methyl-butyric acid Formula: C14H22N2O3S MolecularWeight: 298.40108

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC(=CS1)CCC(=O)NC(C(C)C)C(=O)O

Isomeric SMILES

CC(C)C1=NC(=CS1)CCC(=O)N[C@@H](C(C)C)C(=O)O

InChI

InChI=1S/C14H22N2O3S/c1-8(2)12(14(18)19)16-11(17)6-5-10-7-20-13(15-10)9(3)4/h7-9,12H,5-6H2,1-4H3,(H,16,17)(H,18,19)/t12-/m0/s1