methyl 4-methyl-2-[2-(thiophen-2-ylmethylsulfanyl)ethanoylamino]pentanoate

Systemtic Name: methyl 4-methyl-2-[2-(thiophen-2-ylmethylsulfanyl)ethanoylamino]pentanoate Openeye Name: methyl 4-methyl-2-[[2-(2-thienylmethylsulfanyl)acetyl]amino]pentanoate CAS Name: 4-methyl-2-[[1-oxo-2-(thiophen-2-ylmethylthio)ethyl]amino]pentanoic acid methyl ester IUPAC Name: methyl 4-methyl-2-[[2-(thiophen-2-ylmethylsulfanyl)acetyl]amino]pentanoate Traditional Name: 4-methyl-2-[[2-(2-thenylthio)acetyl]amino]valeric acid methyl ester Formula: C14H21NO3S2 MolecularWeight: 315.45144

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC)NC(=O)CSCC1=CC=CS1

Isomeric SMILES

CC(C)CC(C(=O)OC)NC(=O)CSCC1=CC=CS1

InChI

InChI=1S/C14H21NO3S2/c1-10(2)7-12(14(17)18-3)15-13(16)9-19-8-11-5-4-6-20-11/h4-6,10,12H,7-9H2,1-3H3,(H,15,16)