methyl 3-[5-[(E)-(carbamothioylhydrazinylidene)methyl]furan-2-yl]benzoate

Systemtic Name: methyl 3-[5-[(E)-(carbamothioylhydrazinylidene)methyl]furan-2-yl]benzoate Openeye Name: methyl 3-[5-[(E)-(carbamothioylhydrazono)methyl]-2-furyl]benzoate CAS Name: 3-[5-[(E)-(carbamothioylhydrazinylidene)methyl]-2-furanyl]benzoic acid methyl ester IUPAC Name: methyl 3-[5-[(E)-(carbamothioylhydrazinylidene)methyl]furan-2-yl]benzoate Traditional Name: 3-[5-[(E)-(thiocarbamoylhydrazono)methyl]-2-furyl]benzoic acid methyl ester Formula: C14H13N3O3S MolecularWeight: 303.33632

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC(=C1)C2=CC=C(O2)C=NNC(=S)N

Isomeric SMILES

COC(=O)C1=CC=CC(=C1)C2=CC=C(O2)/C=N/NC(=S)N

InChI

InChI=1S/C14H13N3O3S/c1-19-13(18)10-4-2-3-9(7-10)12-6-5-11(20-12)8-16-17-14(15)21/h2-8H,1H3,(H3,15,17,21)/b16-8+