phenethyl 4-(tert-butylcarbamothioylamino)-4-oxidanylidene-butanoate

Systemtic Name: phenethyl 4-(tert-butylcarbamothioylamino)-4-oxidanylidene-butanoate Openeye Name: phenethyl 4-(tert-butylcarbamothioylamino)-4-oxo-butanoate CAS Name: 4-[[(tert-butylamino)-sulfanylidenemethyl]amino]-4-oxobutanoic acid phenethyl ester IUPAC Name: phenethyl 4-(tert-butylcarbamothioylamino)-4-oxobutanoate Traditional Name: 4-(tert-butylthiocarbamoylamino)-4-keto-butyric acid phenethyl ester Formula: C17H24N2O3S MolecularWeight: 336.44906

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=S)NC(=O)CCC(=O)OCCC1=CC=CC=C1

Isomeric SMILES

CC(C)(C)NC(=S)NC(=O)CCC(=O)OCCC1=CC=CC=C1

InChI

InChI=1S/C17H24N2O3S/c1-17(2,3)19-16(23)18-14(20)9-10-15(21)22-12-11-13-7-5-4-6-8-13/h4-8H,9-12H2,1-3H3,(H2,18,19,20,23)