octadecyl 2-azanyl-4-methylsulfanyl-butanoate

Systemtic Name: octadecyl 2-azanyl-4-methylsulfanyl-butanoate Openeye Name: octadecyl 2-amino-4-methylsulfanyl-butanoate CAS Name: 2-amino-4-(methylthio)butanoic acid octadecyl ester IUPAC Name: octadecyl 2-amino-4-methylsulfanylbutanoate Traditional Name: 2-amino-4-(methylthio)butyric acid stearyl ester Formula: C23H47NO2S MolecularWeight: 401.68978

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC(=O)C(CCSC)N

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC(=O)C(CCSC)N

InChI

InChI=1S/C23H47NO2S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-26-23(25)22(24)19-21-27-2/h22H,3-21,24H2,1-2H3