methyl 4-[(E)-(2-phenylsulfanylpropanoylhydrazinylidene)methyl]benzoate

Systemtic Name: methyl 4-[(E)-(2-phenylsulfanylpropanoylhydrazinylidene)methyl]benzoate Openeye Name: methyl 4-[(E)-(2-phenylsulfanylpropanoylhydrazono)methyl]benzoate CAS Name: 4-[(E)-[[1-oxo-2-(phenylthio)propyl]hydrazinylidene]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-(2-phenylsulfanylpropanoylhydrazinylidene)methyl]benzoate Traditional Name: 4-[(E)-[2-(phenylthio)propanoylhydrazono]methyl]benzoic acid methyl ester Formula: C18H18N2O3S MolecularWeight: 342.41212

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NN=CC1=CC=C(C=C1)C(=O)OC)SC2=CC=CC=C2

Isomeric SMILES

CC(C(=O)N/N=C/C1=CC=C(C=C1)C(=O)OC)SC2=CC=CC=C2

InChI

InChI=1S/C18H18N2O3S/c1-13(24-16-6-4-3-5-7-16)17(21)20-19-12-14-8-10-15(11-9-14)18(22)23-2/h3-13H,1-2H3,(H,20,21)/b19-12+