methyl 3-methyl-2-(2-pyridin-2-ylsulfanylethanoylamino)pentanoate

Systemtic Name: methyl 3-methyl-2-(2-pyridin-2-ylsulfanylethanoylamino)pentanoate Openeye Name: methyl 3-methyl-2-[[2-(2-pyridylsulfanyl)acetyl]amino]pentanoate CAS Name: 3-methyl-2-[[1-oxo-2-(2-pyridinylthio)ethyl]amino]pentanoic acid methyl ester IUPAC Name: methyl 3-methyl-2-[(2-pyridin-2-ylsulfanylacetyl)amino]pentanoate Traditional Name: 3-methyl-2-[[2-(2-pyridylthio)acetyl]amino]valeric acid methyl ester Formula: C14H20N2O3S MolecularWeight: 296.3852

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OC)NC(=O)CSC1=CC=CC=N1

Isomeric SMILES

CCC(C)C(C(=O)OC)NC(=O)CSC1=CC=CC=N1

InChI

InChI=1S/C14H20N2O3S/c1-4-10(2)13(14(18)19-3)16-11(17)9-20-12-7-5-6-8-15-12/h5-8,10,13H,4,9H2,1-3H3,(H,16,17)