methyl 4-methyl-2-[1-(4-methylsulfanylphenyl)ethylamino]pentanoate

Systemtic Name: methyl 4-methyl-2-[1-(4-methylsulfanylphenyl)ethylamino]pentanoate Openeye Name: methyl 4-methyl-2-[1-(4-methylsulfanylphenyl)ethylamino]pentanoate CAS Name: 4-methyl-2-[1-[4-(methylthio)phenyl]ethylamino]pentanoic acid methyl ester IUPAC Name: methyl 4-methyl-2-[1-(4-methylsulfanylphenyl)ethylamino]pentanoate Traditional Name: 4-methyl-2-[1-[4-(methylthio)phenyl]ethylamino]valeric acid methyl ester Formula: C16H25NO2S MolecularWeight: 295.4402

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC)NC(C)C1=CC=C(C=C1)SC

Isomeric SMILES

CC(C)CC(C(=O)OC)NC(C)C1=CC=C(C=C1)SC

InChI

InChI=1S/C16H25NO2S/c1-11(2)10-15(16(18)19-4)17-12(3)13-6-8-14(20-5)9-7-13/h6-9,11-12,15,17H,10H2,1-5H3