2-methoxyethyl 4-oxidanylidene-4-(phenylcarbamothioylamino)butanoate

Systemtic Name: 2-methoxyethyl 4-oxidanylidene-4-(phenylcarbamothioylamino)butanoate Openeye Name: 2-methoxyethyl 4-oxo-4-(phenylcarbamothioylamino)butanoate CAS Name: 4-[[anilino(sulfanylidene)methyl]amino]-4-oxobutanoic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl 4-oxo-4-(phenylcarbamothioylamino)butanoate Traditional Name: 4-keto-4-(phenylthiocarbamoylamino)butyric acid 2-methoxyethyl ester Formula: C14H18N2O4S MolecularWeight: 310.36872

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC(=O)CCC(=O)NC(=S)NC1=CC=CC=C1

Isomeric SMILES

COCCOC(=O)CCC(=O)NC(=S)NC1=CC=CC=C1

InChI

InChI=1S/C14H18N2O4S/c1-19-9-10-20-13(18)8-7-12(17)16-14(21)15-11-5-3-2-4-6-11/h2-6H,7-10H2,1H3,(H2,15,16,17,21)