4-methyl-2-[2-(4-methylphenyl)sulfanylethanoylamino]pentanoic acid

Systemtic Name: 4-methyl-2-[2-(4-methylphenyl)sulfanylethanoylamino]pentanoic acid Openeye Name: 4-methyl-2-[[2-(p-tolylsulfanyl)acetyl]amino]pentanoic acid CAS Name: 4-methyl-2-[[2-[(4-methylphenyl)thio]-1-oxoethyl]amino]pentanoic acid IUPAC Name: 4-methyl-2-[[2-(4-methylphenyl)sulfanylacetyl]amino]pentanoic acid Traditional Name: 4-methyl-2-[[2-(p-tolylthio)acetyl]amino]valeric acid Formula: C15H21NO3S MolecularWeight: 295.39714

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC(=O)NC(CC(C)C)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)SCC(=O)NC(CC(C)C)C(=O)O

InChI

InChI=1S/C15H21NO3S/c1-10(2)8-13(15(18)19)16-14(17)9-20-12-6-4-11(3)5-7-12/h4-7,10,13H,8-9H2,1-3H3,(H,16,17)(H,18,19)