tert-butyl 2-[4-[(E)-(2-pyrimidin-2-ylsulfanylethanoylhydrazinylidene)methyl]phenoxy]ethanoate

Systemtic Name: tert-butyl 2-[4-[(E)-(2-pyrimidin-2-ylsulfanylethanoylhydrazinylidene)methyl]phenoxy]ethanoate Openeye Name: tert-butyl 2-[4-[(E)-[(2-pyrimidin-2-ylsulfanylacetyl)hydrazono]methyl]phenoxy]acetate CAS Name: 2-[4-[(E)-[[1-oxo-2-(2-pyrimidinylthio)ethyl]hydrazinylidene]methyl]phenoxy]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[4-[(E)-[(2-pyrimidin-2-ylsulfanylacetyl)hydrazinylidene]methyl]phenoxy]acetate Traditional Name: 2-[4-[(E)-[[2-(2-pyrimidylthio)acetyl]hydrazono]methyl]phenoxy]acetic acid tert-butyl ester Formula: C19H22N4O4S MolecularWeight: 402.46738

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)COC1=CC=C(C=C1)C=NNC(=O)CSC2=NC=CC=N2

Isomeric SMILES

CC(C)(C)OC(=O)COC1=CC=C(C=C1)/C=N/NC(=O)CSC2=NC=CC=N2

InChI

InChI=1S/C19H22N4O4S/c1-19(2,3)27-17(25)12-26-15-7-5-14(6-8-15)11-22-23-16(24)13-28-18-20-9-4-10-21-18/h4-11H,12-13H2,1-3H3,(H,23,24)/b22-11+