methyl (2S)-2-(cyclooctylcarbamoylamino)-4-methylsulfanyl-butanoate

Systemtic Name: methyl (2S)-2-(cyclooctylcarbamoylamino)-4-methylsulfanyl-butanoate Openeye Name: methyl (2S)-2-(cyclooctylcarbamoylamino)-4-methylsulfanyl-butanoate CAS Name: (2S)-2-[[(cyclooctylamino)-oxomethyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl (2S)-2-(cyclooctylcarbamoylamino)-4-methylsulfanylbutanoate Traditional Name: (2S)-2-(cyclooctylcarbamoylamino)-4-(methylthio)butyric acid methyl ester Formula: C15H28N2O3S MolecularWeight: 316.45942

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCSC)NC(=O)NC1CCCCCCC1

Isomeric SMILES

COC(=O)[C@H](CCSC)NC(=O)NC1CCCCCCC1

InChI

InChI=1S/C15H28N2O3S/c1-20-14(18)13(10-11-21-2)17-15(19)16-12-8-6-4-3-5-7-9-12/h12-13H,3-11H2,1-2H3,(H2,16,17,19)/t13-/m0/s1