4-[(E)-[(5-thiophen-2-yl-1H-pyrazol-3-yl)carbonylhydrazinylidene]methyl]benzoic acid

Systemtic Name: 4-[(E)-[(5-thiophen-2-yl-1H-pyrazol-3-yl)carbonylhydrazinylidene]methyl]benzoic acid Openeye Name: 4-[(E)-[[5-(2-thienyl)-1H-pyrazole-3-carbonyl]hydrazono]methyl]benzoic acid CAS Name: 4-[(E)-[[oxo-(5-thiophen-2-yl-1H-pyrazol-3-yl)methyl]hydrazinylidene]methyl]benzoic acid IUPAC Name: 4-[(E)-[(5-thiophen-2-yl-1H-pyrazole-3-carbonyl)hydrazinylidene]methyl]benzoic acid Traditional Name: 4-[(E)-[[5-(2-thienyl)-1H-pyrazole-3-carbonyl]hydrazono]methyl]benzoic acid Formula: C16H12N4O3S MolecularWeight: 340.35648

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=CC(=NN2)C(=O)NN=CC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

C1=CSC(=C1)C2=CC(=NN2)C(=O)N/N=C/C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C16H12N4O3S/c21-15(13-8-12(18-19-13)14-2-1-7-24-14)20-17-9-10-3-5-11(6-4-10)16(22)23/h1-9H,(H,18,19)(H,20,21)(H,22,23)/b17-9+