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

Systemtic Name: 4-[[4-[(E)-(ethylcarbamothioylhydrazinylidene)methyl]-2-methoxy-phenoxy]methyl]benzoic acid Openeye Name: 4-[[4-[(E)-(ethylcarbamothioylhydrazono)methyl]-2-methoxy-phenoxy]methyl]benzoic acid CAS Name: 4-[[4-[(E)-[[ethylamino(sulfanylidene)methyl]hydrazinylidene]methyl]-2-methoxyphenoxy]methyl]benzoic acid IUPAC Name: 4-[[4-[(E)-(ethylcarbamothioylhydrazinylidene)methyl]-2-methoxyphenoxy]methyl]benzoic acid Traditional Name: 4-[[4-[(E)-(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=C(C=C2)C(=O)O)OC

Isomeric SMILES

CCNC(=S)N/N=C/C1=CC(=C(C=C1)OCC2=CC=C(C=C2)C(=O)O)OC

InChI

InChI=1S/C19H21N3O4S/c1-3-20-19(27)22-21-11-14-6-9-16(17(10-14)25-2)26-12-13-4-7-15(8-5-13)18(23)24/h4-11H,3,12H2,1-2H3,(H,23,24)(H2,20,22,27)/b21-11+