5-[[4-[(E)-(carbamothioylhydrazinylidene)methyl]-2-methoxy-phenoxy]methyl]furan-2-carboxylic acid

Systemtic Name: 5-[[4-[(E)-(carbamothioylhydrazinylidene)methyl]-2-methoxy-phenoxy]methyl]furan-2-carboxylic acid Openeye Name: 5-[[4-[(E)-(carbamothioylhydrazono)methyl]-2-methoxy-phenoxy]methyl]furan-2-carboxylic acid CAS Name: 5-[[4-[(E)-(carbamothioylhydrazinylidene)methyl]-2-methoxyphenoxy]methyl]-2-furancarboxylic acid IUPAC Name: 5-[[4-[(E)-(carbamothioylhydrazinylidene)methyl]-2-methoxyphenoxy]methyl]furan-2-carboxylic acid Traditional Name: 5-[[2-methoxy-4-[(E)-(thiocarbamoylhydrazono)methyl]phenoxy]methyl]-2-furoic acid Formula: C15H15N3O5S MolecularWeight: 349.3617

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=NNC(=S)N)OCC2=CC=C(O2)C(=O)O

Isomeric SMILES

COC1=C(C=CC(=C1)/C=N/NC(=S)N)OCC2=CC=C(O2)C(=O)O

InChI

InChI=1S/C15H15N3O5S/c1-21-13-6-9(7-17-18-15(16)24)2-4-11(13)22-8-10-3-5-12(23-10)14(19)20/h2-7H,8H2,1H3,(H,19,20)(H3,16,18,24)/b17-7+