propyl 4-[2-oxidanylidene-2-[2-(propanoylcarbamothioyl)hydrazinyl]ethoxy]benzoate

Systemtic Name: propyl 4-[2-oxidanylidene-2-[2-(propanoylcarbamothioyl)hydrazinyl]ethoxy]benzoate Openeye Name: propyl 4-[2-oxo-2-[2-(propanoylcarbamothioyl)hydrazino]ethoxy]benzoate CAS Name: 4-[2-oxo-2-[[(1-oxopropylamino)-sulfanylidenemethyl]hydrazo]ethoxy]benzoic acid propyl ester IUPAC Name: propyl 4-[2-oxo-2-[2-(propanoylcarbamothioyl)hydrazinyl]ethoxy]benzoate Traditional Name: 4-[2-keto-2-[N'-(propionylthiocarbamoyl)hydrazino]ethoxy]benzoic acid propyl ester Formula: C16H21N3O5S MolecularWeight: 367.42004

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)OCC(=O)NNC(=S)NC(=O)CC

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)OCC(=O)NNC(=S)NC(=O)CC

InChI

InChI=1S/C16H21N3O5S/c1-3-9-23-15(22)11-5-7-12(8-6-11)24-10-14(21)18-19-16(25)17-13(20)4-2/h5-8H,3-4,9-10H2,1-2H3,(H,18,21)(H2,17,19,20,25)