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

Systemtic Name: propyl 4-[2-[2-[2-(2-methylphenyl)ethanoylcarbamothioyl]hydrazinyl]-2-oxidanylidene-ethoxy]benzoate Openeye Name: propyl 4-[2-[2-[[2-(o-tolyl)acetyl]carbamothioyl]hydrazino]-2-oxo-ethoxy]benzoate CAS Name: 4-[2-[[[[2-(2-methylphenyl)-1-oxoethyl]amino]-sulfanylidenemethyl]hydrazo]-2-oxoethoxy]benzoic acid propyl ester IUPAC Name: propyl 4-[2-[2-[[2-(2-methylphenyl)acetyl]carbamothioyl]hydrazinyl]-2-oxoethoxy]benzoate Traditional Name: 4-[2-keto-2-[N'-[[2-(o-tolyl)acetyl]thiocarbamoyl]hydrazino]ethoxy]benzoic acid propyl ester Formula: C22H25N3O5S MolecularWeight: 443.516

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)OCC(=O)NNC(=S)NC(=O)CC2=CC=CC=C2C

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)OCC(=O)NNC(=S)NC(=O)CC2=CC=CC=C2C

InChI

InChI=1S/C22H25N3O5S/c1-3-12-29-21(28)16-8-10-18(11-9-16)30-14-20(27)24-25-22(31)23-19(26)13-17-7-5-4-6-15(17)2/h4-11H,3,12-14H2,1-2H3,(H,24,27)(H2,23,25,26,31)