phenethyl 4-(ethylcarbamothioylamino)-4-oxidanylidene-butanoate

Systemtic Name: phenethyl 4-(ethylcarbamothioylamino)-4-oxidanylidene-butanoate Openeye Name: phenethyl 4-(ethylcarbamothioylamino)-4-oxo-butanoate CAS Name: 4-[[ethylamino(sulfanylidene)methyl]amino]-4-oxobutanoic acid phenethyl ester IUPAC Name: phenethyl 4-(ethylcarbamothioylamino)-4-oxobutanoate Traditional Name: 4-(ethylthiocarbamoylamino)-4-keto-butyric acid phenethyl ester Formula: C15H20N2O3S MolecularWeight: 308.3959

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H20N2O3S/c1-2-16-15(21)17-13(18)8-9-14(19)20-11-10-12-6-4-3-5-7-12/h3-7H,2,8-11H2,1H3,(H2,16,17,18,21)