4-chloranyl-3-[5-[(E)-(phenylcarbamothioylhydrazinylidene)methyl]furan-2-yl]benzoic acid

Systemtic Name: 4-chloranyl-3-[5-[(E)-(phenylcarbamothioylhydrazinylidene)methyl]furan-2-yl]benzoic acid Openeye Name: 4-chloro-3-[5-[(E)-(phenylcarbamothioylhydrazono)methyl]-2-furyl]benzoic acid CAS Name: 3-[5-[(E)-[[anilino(sulfanylidene)methyl]hydrazinylidene]methyl]-2-furanyl]-4-chlorobenzoic acid IUPAC Name: 4-chloro-3-[5-[(E)-(phenylcarbamothioylhydrazinylidene)methyl]furan-2-yl]benzoic acid Traditional Name: 4-chloro-3-[5-[(E)-(phenylthiocarbamoylhydrazono)methyl]-2-furyl]benzoic acid Formula: C19H14ClN3O3S MolecularWeight: 399.85076

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=S)NN=CC2=CC=C(O2)C3=C(C=CC(=C3)C(=O)O)Cl

Isomeric SMILES

C1=CC=C(C=C1)NC(=S)N/N=C/C2=CC=C(O2)C3=C(C=CC(=C3)C(=O)O)Cl

InChI

InChI=1S/C19H14ClN3O3S/c20-16-8-6-12(18(24)25)10-15(16)17-9-7-14(26-17)11-21-23-19(27)22-13-4-2-1-3-5-13/h1-11H,(H,24,25)(H2,22,23,27)/b21-11+