propyl 4-[(2-ethyl-6-methyl-phenyl)carbamothioylamino]-4-oxidanylidene-butanoate

Systemtic Name: propyl 4-[(2-ethyl-6-methyl-phenyl)carbamothioylamino]-4-oxidanylidene-butanoate Openeye Name: propyl 4-[(2-ethyl-6-methyl-phenyl)carbamothioylamino]-4-oxo-butanoate CAS Name: 4-[[(2-ethyl-6-methylanilino)-sulfanylidenemethyl]amino]-4-oxobutanoic acid propyl ester IUPAC Name: propyl 4-[(2-ethyl-6-methylphenyl)carbamothioylamino]-4-oxobutanoate Traditional Name: 4-[(2-ethyl-6-methyl-phenyl)thiocarbamoylamino]-4-keto-butyric acid propyl ester Formula: C17H24N2O3S MolecularWeight: 336.44906

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)CCC(=O)NC(=S)NC1=C(C=CC=C1CC)C

Isomeric SMILES

CCCOC(=O)CCC(=O)NC(=S)NC1=C(C=CC=C1CC)C

InChI

InChI=1S/C17H24N2O3S/c1-4-11-22-15(21)10-9-14(20)18-17(23)19-16-12(3)7-6-8-13(16)5-2/h6-8H,4-5,9-11H2,1-3H3,(H2,18,19,20,23)