ethyl 4-[2-[2-[(3-butan-2-yloxyphenyl)carbonylcarbamothioyl]hydrazinyl]-2-oxidanylidene-ethoxy]benzoate

Systemtic Name: ethyl 4-[2-[2-[(3-butan-2-yloxyphenyl)carbonylcarbamothioyl]hydrazinyl]-2-oxidanylidene-ethoxy]benzoate Openeye Name: ethyl 4-[2-oxo-2-[2-[(3-sec-butoxybenzoyl)carbamothioyl]hydrazino]ethoxy]benzoate CAS Name: 4-[2-[[[[(3-butan-2-yloxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]hydrazo]-2-oxoethoxy]benzoic acid ethyl ester IUPAC Name: ethyl 4-[2-[2-[(3-butan-2-yloxybenzoyl)carbamothioyl]hydrazinyl]-2-oxoethoxy]benzoate Traditional Name: 4-[2-keto-2-[N'-[(3-sec-butoxybenzoyl)thiocarbamoyl]hydrazino]ethoxy]benzoic acid ethyl ester Formula: C23H27N3O6S MolecularWeight: 473.54198

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC1=CC=CC(=C1)C(=O)NC(=S)NNC(=O)COC2=CC=C(C=C2)C(=O)OCC

Isomeric SMILES

CCC(C)OC1=CC=CC(=C1)C(=O)NC(=S)NNC(=O)COC2=CC=C(C=C2)C(=O)OCC

InChI

InChI=1S/C23H27N3O6S/c1-4-15(3)32-19-8-6-7-17(13-19)21(28)24-23(33)26-25-20(27)14-31-18-11-9-16(10-12-18)22(29)30-5-2/h6-13,15H,4-5,14H2,1-3H3,(H,25,27)(H2,24,26,28,33)