2-[[2-[2-(dimethylamino)-2-oxidanylidene-ethyl]-1,3-thiazol-4-yl]methylamino]-3-methyl-butanoic acid

Systemtic Name: 2-[[2-[2-(dimethylamino)-2-oxidanylidene-ethyl]-1,3-thiazol-4-yl]methylamino]-3-methyl-butanoic acid Openeye Name: 2-[[2-[2-(dimethylamino)-2-oxo-ethyl]thiazol-4-yl]methylamino]-3-methyl-butanoic acid CAS Name: 2-[[2-[2-(dimethylamino)-2-oxoethyl]-4-thiazolyl]methylamino]-3-methylbutanoic acid IUPAC Name: 2-[[2-[2-(dimethylamino)-2-oxoethyl]-1,3-thiazol-4-yl]methylamino]-3-methylbutanoic acid Traditional Name: 2-[[2-[2-(dimethylamino)-2-keto-ethyl]thiazol-4-yl]methylamino]-3-methyl-butyric acid Formula: C13H21N3O3S MolecularWeight: 299.38914

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NCC1=CSC(=N1)CC(=O)N(C)C

Isomeric SMILES

CC(C)C(C(=O)O)NCC1=CSC(=N1)CC(=O)N(C)C

InChI

InChI=1S/C13H21N3O3S/c1-8(2)12(13(18)19)14-6-9-7-20-10(15-9)5-11(17)16(3)4/h7-8,12,14H,5-6H2,1-4H3,(H,18,19)