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

Systemtic Name: 2-[(2-acetamido-1,3-thiazol-4-yl)methylamino]-3-methyl-butanoic acid Openeye Name: 2-[(2-acetamidothiazol-4-yl)methylamino]-3-methyl-butanoic acid CAS Name: 2-[(2-acetamido-4-thiazolyl)methylamino]-3-methylbutanoic acid IUPAC Name: 2-[(2-acetamido-1,3-thiazol-4-yl)methylamino]-3-methylbutanoic acid Traditional Name: 2-[(2-acetamidothiazol-4-yl)methylamino]-3-methyl-butyric acid Formula: C11H17N3O3S MolecularWeight: 271.33598

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H17N3O3S/c1-6(2)9(10(16)17)12-4-8-5-18-11(14-8)13-7(3)15/h5-6,9,12H,4H2,1-3H3,(H,16,17)(H,13,14,15)