2-[4-methyl-2-(pyridin-2-ylcarbonylamino)pentyl]sulfanylethanoate hydrochloride

Systemtic Name: 2-[4-methyl-2-(pyridin-2-ylcarbonylamino)pentyl]sulfanylethanoate hydrochloride Openeye Name: 2-[4-methyl-2-(pyridine-2-carbonylamino)pentyl]sulfanylacetate hydrochloride CAS Name: 2-[[4-methyl-2-[[oxo(2-pyridinyl)methyl]amino]pentyl]thio]acetate hydrochloride IUPAC Name: 2-[4-methyl-2-(pyridine-2-carbonylamino)pentyl]sulfanylacetate hydrochloride Traditional Name: 2-[(4-methyl-2-picolinamido-pentyl)thio]acetate hydrochloride Formula: C14H20ClN2O3S- MolecularWeight: 331.8382

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CSCC(=O)[O-])NC(=O)C1=CC=CC=N1.Cl

Isomeric SMILES

CC(C)CC(CSCC(=O)[O-])NC(=O)C1=CC=CC=N1.Cl

InChI

InChI=1S/C14H20N2O3S.ClH/c1-10(2)7-11(8-20-9-13(17)18)16-14(19)12-5-3-4-6-15-12;/h3-6,10-11H,7-9H2,1-2H3,(H,16,19)(H,17,18);1H/p-1