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methyl 2-azanyl-2-(2-methylsulfanylethyl)-3-oxidanylidene-octadecanoate

methyl 2-azanyl-2-(2-methylsulfanylethyl)-3-oxidanylidene-octadecanoate

Systemtic Name:methyl 2-azanyl-2-(2-methylsulfanylethyl)-3-oxidanylidene-octadecanoate
Openeye Name:methyl 2-amino-2-(2-methylsulfanylethyl)-3-oxo-octadecanoate
CAS Name:2-amino-2-[2-(methylthio)ethyl]-3-oxooctadecanoic acid methyl ester
IUPAC Name:methyl 2-amino-2-(2-methylsulfanylethyl)-3-oxooctadecanoate
Traditional Name:2-amino-3-keto-2-[2-(methylthio)ethyl]stearic acid methyl ester
Formula: C22H43NO3S
MolecularWeight: 401.64672
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)C(CCSC)(C(=O)OC)N


Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)C(CCSC)(C(=O)OC)N


InChI

InChI=1S/C22H43NO3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(24)22(23,18-19-27-3)21(25)26-2/h4-19,23H2,1-3H3


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