methyl (2S)-3-methyl-2-[1-(4-methyl-1,3-thiazol-5-yl)ethylamino]butanoate

Systemtic Name: methyl (2S)-3-methyl-2-[1-(4-methyl-1,3-thiazol-5-yl)ethylamino]butanoate Openeye Name: methyl (2S)-3-methyl-2-[1-(4-methylthiazol-5-yl)ethylamino]butanoate CAS Name: (2S)-3-methyl-2-[1-(4-methyl-5-thiazolyl)ethylamino]butanoic acid methyl ester IUPAC Name: methyl (2S)-3-methyl-2-[1-(4-methyl-1,3-thiazol-5-yl)ethylamino]butanoate Traditional Name: (2S)-3-methyl-2-[1-(4-methylthiazol-5-yl)ethylamino]butyric acid methyl ester Formula: C12H20N2O2S MolecularWeight: 256.3644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=N1)C(C)NC(C(C)C)C(=O)OC

Isomeric SMILES

CC1=C(SC=N1)C(C)N[C@@H](C(C)C)C(=O)OC

InChI

InChI=1S/C12H20N2O2S/c1-7(2)10(12(15)16-5)14-9(4)11-8(3)13-6-17-11/h6-7,9-10,14H,1-5H3/t9?,10-/m0/s1