methyl 2-methyl-2-[2-(2-methylphenyl)sulfanylethanoylamino]pentanoate

Systemtic Name: methyl 2-methyl-2-[2-(2-methylphenyl)sulfanylethanoylamino]pentanoate Openeye Name: methyl 2-methyl-2-[[2-(o-tolylsulfanyl)acetyl]amino]pentanoate CAS Name: 2-methyl-2-[[2-[(2-methylphenyl)thio]-1-oxoethyl]amino]pentanoic acid methyl ester IUPAC Name: methyl 2-methyl-2-[[2-(2-methylphenyl)sulfanylacetyl]amino]pentanoate Traditional Name: 2-methyl-2-[[2-(o-tolylthio)acetyl]amino]valeric acid methyl ester Formula: C16H23NO3S MolecularWeight: 309.42372

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)(C(=O)OC)NC(=O)CSC1=CC=CC=C1C

Isomeric SMILES

CCCC(C)(C(=O)OC)NC(=O)CSC1=CC=CC=C1C

InChI

InChI=1S/C16H23NO3S/c1-5-10-16(3,15(19)20-4)17-14(18)11-21-13-9-7-6-8-12(13)2/h6-9H,5,10-11H2,1-4H3,(H,17,18)