2-[(E)-[2-[(3,5-dimethylphenyl)methylsulfanyl]ethanoylhydrazinylidene]methyl]benzoic acid

Systemtic Name: 2-[(E)-[2-[(3,5-dimethylphenyl)methylsulfanyl]ethanoylhydrazinylidene]methyl]benzoic acid Openeye Name: 2-[(E)-[[2-[(3,5-dimethylphenyl)methylsulfanyl]acetyl]hydrazono]methyl]benzoic acid CAS Name: 2-[(E)-[[2-[(3,5-dimethylphenyl)methylthio]-1-oxoethyl]hydrazinylidene]methyl]benzoic acid IUPAC Name: 2-[(E)-[[2-[(3,5-dimethylphenyl)methylsulfanyl]acetyl]hydrazinylidene]methyl]benzoic acid Traditional Name: 2-[(E)-[[2-[(3,5-dimethylbenzyl)thio]acetyl]hydrazono]methyl]benzoic acid Formula: C19H20N2O3S MolecularWeight: 356.4387

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)CSCC(=O)NN=CC2=CC=CC=C2C(=O)O)C

Isomeric SMILES

CC1=CC(=CC(=C1)CSCC(=O)N/N=C/C2=CC=CC=C2C(=O)O)C

InChI

InChI=1S/C19H20N2O3S/c1-13-7-14(2)9-15(8-13)11-25-12-18(22)21-20-10-16-5-3-4-6-17(16)19(23)24/h3-10H,11-12H2,1-2H3,(H,21,22)(H,23,24)/b20-10+