propyl 4-oxidanylidene-4-(1-phenylpropylcarbamothioylamino)butanoate

Systemtic Name: propyl 4-oxidanylidene-4-(1-phenylpropylcarbamothioylamino)butanoate Openeye Name: propyl 4-oxo-4-(1-phenylpropylcarbamothioylamino)butanoate CAS Name: 4-oxo-4-[[(1-phenylpropylamino)-sulfanylidenemethyl]amino]butanoic acid propyl ester IUPAC Name: propyl 4-oxo-4-(1-phenylpropylcarbamothioylamino)butanoate Traditional Name: 4-keto-4-(1-phenylpropylthiocarbamoylamino)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)NC(CC)C1=CC=CC=C1

Isomeric SMILES

CCCOC(=O)CCC(=O)NC(=S)NC(CC)C1=CC=CC=C1

InChI

InChI=1S/C17H24N2O3S/c1-3-12-22-16(21)11-10-15(20)19-17(23)18-14(4-2)13-8-6-5-7-9-13/h5-9,14H,3-4,10-12H2,1-2H3,(H2,18,19,20,23)