propyl 4-(hexadecylcarbamothioylamino)-4-oxidanylidene-butanoate

Systemtic Name: propyl 4-(hexadecylcarbamothioylamino)-4-oxidanylidene-butanoate Openeye Name: propyl 4-(hexadecylcarbamothioylamino)-4-oxo-butanoate CAS Name: 4-[[(hexadecylamino)-sulfanylidenemethyl]amino]-4-oxobutanoic acid propyl ester IUPAC Name: propyl 4-(hexadecylcarbamothioylamino)-4-oxobutanoate Traditional Name: 4-(cetylthiocarbamoylamino)-4-keto-butyric acid propyl ester Formula: C24H46N2O3S MolecularWeight: 442.69864

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H46N2O3S/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-20-25-24(30)26-22(27)18-19-23(28)29-21-4-2/h3-21H2,1-2H3,(H2,25,26,27,30)