3-[[4-[(ethylcarbamothioylhydrazinylidene)methyl]-2-methoxy-phenoxy]methyl]benzoic acid

Systemtic Name: 3-[[4-[(ethylcarbamothioylhydrazinylidene)methyl]-2-methoxy-phenoxy]methyl]benzoic acid Openeye Name: 3-[[4-[(ethylcarbamothioylhydrazono)methyl]-2-methoxy-phenoxy]methyl]benzoic acid CAS Name: 3-[[4-[[[ethylamino(sulfanylidene)methyl]hydrazinylidene]methyl]-2-methoxyphenoxy]methyl]benzoic acid IUPAC Name: 3-[[4-[(ethylcarbamothioylhydrazinylidene)methyl]-2-methoxyphenoxy]methyl]benzoic acid Traditional Name: 3-[[4-[(ethylthiocarbamoylhydrazono)methyl]-2-methoxy-phenoxy]methyl]benzoic acid Formula: C19H21N3O4S MolecularWeight: 387.45274

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NN=CC1=CC(=C(C=C1)OCC2=CC=CC(=C2)C(=O)O)OC

Isomeric SMILES

CCNC(=S)NN=CC1=CC(=C(C=C1)OCC2=CC=CC(=C2)C(=O)O)OC

InChI

InChI=1S/C19H21N3O4S/c1-3-20-19(27)22-21-11-13-7-8-16(17(10-13)25-2)26-12-14-5-4-6-15(9-14)18(23)24/h4-11H,3,12H2,1-2H3,(H,23,24)(H2,20,22,27)