methyl 4-[2-[2-[(4-chlorophenyl)carbamothioyl]hydrazinyl]-2-oxidanylidene-ethoxy]benzoate

Systemtic Name: methyl 4-[2-[2-[(4-chlorophenyl)carbamothioyl]hydrazinyl]-2-oxidanylidene-ethoxy]benzoate Openeye Name: methyl 4-[2-[2-[(4-chlorophenyl)carbamothioyl]hydrazino]-2-oxo-ethoxy]benzoate CAS Name: 4-[2-[[(4-chloroanilino)-sulfanylidenemethyl]hydrazo]-2-oxoethoxy]benzoic acid methyl ester IUPAC Name: methyl 4-[2-[2-[(4-chlorophenyl)carbamothioyl]hydrazinyl]-2-oxoethoxy]benzoate Traditional Name: 4-[2-[N'-[(4-chlorophenyl)thiocarbamoyl]hydrazino]-2-keto-ethoxy]benzoic acid methyl ester Formula: C17H16ClN3O4S MolecularWeight: 393.84464

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)OCC(=O)NNC(=S)NC2=CC=C(C=C2)Cl

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)OCC(=O)NNC(=S)NC2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H16ClN3O4S/c1-24-16(23)11-2-8-14(9-3-11)25-10-15(22)20-21-17(26)19-13-6-4-12(18)5-7-13/h2-9H,10H2,1H3,(H,20,22)(H2,19,21,26)