2-[(2,6-dimethylphenyl)-(3-ethoxy-3-oxidanylidene-propanethioyl)amino]propanoate

Systemtic Name: 2-[(2,6-dimethylphenyl)-(3-ethoxy-3-oxidanylidene-propanethioyl)amino]propanoate Openeye Name: 2-(N-(3-ethoxy-3-oxo-propanethioyl)-2,6-dimethyl-anilino)propanoate CAS Name: 2-(N-(3-ethoxy-3-oxo-1-sulfanylidenepropyl)-2,6-dimethylanilino)propanoate IUPAC Name: 2-(N-(3-ethoxy-3-oxopropanethioyl)-2,6-dimethylanilino)propanoate Traditional Name: 2-(N-(3-ethoxy-3-keto-propanethioyl)-2,6-dimethyl-anilino)propionate Formula: C16H20NO4S- MolecularWeight: 322.3993

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=S)N(C1=C(C=CC=C1C)C)C(C)C(=O)[O-]

Isomeric SMILES

CCOC(=O)CC(=S)N(C1=C(C=CC=C1C)C)C(C)C(=O)[O-]

InChI

InChI=1S/C16H21NO4S/c1-5-21-14(18)9-13(22)17(12(4)16(19)20)15-10(2)7-6-8-11(15)3/h6-8,12H,5,9H2,1-4H3,(H,19,20)/p-1