(1-azanyl-3-hexadecylsulfanyl-propan-2-yl) N-methylcarbamate

Systemtic Name: (1-azanyl-3-hexadecylsulfanyl-propan-2-yl) N-methylcarbamate Openeye Name: [1-(aminomethyl)-2-hexadecylsulfanyl-ethyl] N-methylcarbamate CAS Name: N-methylcarbamic acid [1-amino-3-(hexadecylthio)propan-2-yl] ester IUPAC Name: (1-amino-3-hexadecylsulfanylpropan-2-yl) N-methylcarbamate Traditional Name: N-methylcarbamic acid [1-(aminomethyl)-2-(cetylthio)ethyl] ester Formula: C21H44N2O2S MolecularWeight: 388.65126

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCSCC(CN)OC(=O)NC

Isomeric SMILES

CCCCCCCCCCCCCCCCSCC(CN)OC(=O)NC

InChI

InChI=1S/C21H44N2O2S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-26-19-20(18-22)25-21(24)23-2/h20H,3-19,22H2,1-2H3,(H,23,24)