2-methoxyethyl 4-(hexadecylcarbamothioylamino)-4-oxidanylidene-butanoate

Systemtic Name: 2-methoxyethyl 4-(hexadecylcarbamothioylamino)-4-oxidanylidene-butanoate Openeye Name: 2-methoxyethyl 4-(hexadecylcarbamothioylamino)-4-oxo-butanoate CAS Name: 4-[[(hexadecylamino)-sulfanylidenemethyl]amino]-4-oxobutanoic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl 4-(hexadecylcarbamothioylamino)-4-oxobutanoate Traditional Name: 4-(cetylthiocarbamoylamino)-4-keto-butyric acid 2-methoxyethyl ester Formula: C24H46N2O4S MolecularWeight: 458.69804

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNC(=S)NC(=O)CCC(=O)OCCOC

Isomeric SMILES

CCCCCCCCCCCCCCCCNC(=S)NC(=O)CCC(=O)OCCOC

InChI

InChI=1S/C24H46N2O4S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-25-24(31)26-22(27)17-18-23(28)30-21-20-29-2/h3-21H2,1-2H3,(H2,25,26,27,31)