methyl 3-methyl-2-[2-(1-methylimidazol-2-yl)sulfanylethanoylamino]pentanoate

Systemtic Name: methyl 3-methyl-2-[2-(1-methylimidazol-2-yl)sulfanylethanoylamino]pentanoate Openeye Name: methyl 3-methyl-2-[[2-(1-methylimidazol-2-yl)sulfanylacetyl]amino]pentanoate CAS Name: 3-methyl-2-[[2-[(1-methyl-2-imidazolyl)thio]-1-oxoethyl]amino]pentanoic acid methyl ester IUPAC Name: methyl 3-methyl-2-[[2-(1-methylimidazol-2-yl)sulfanylacetyl]amino]pentanoate Traditional Name: 3-methyl-2-[[2-[(1-methylimidazol-2-yl)thio]acetyl]amino]valeric acid methyl ester Formula: C13H21N3O3S MolecularWeight: 299.38914

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OC)NC(=O)CSC1=NC=CN1C

Isomeric SMILES

CCC(C)C(C(=O)OC)NC(=O)CSC1=NC=CN1C

InChI

InChI=1S/C13H21N3O3S/c1-5-9(2)11(12(18)19-4)15-10(17)8-20-13-14-6-7-16(13)3/h6-7,9,11H,5,8H2,1-4H3,(H,15,17)