3-[(2E)-2-[(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)methylidene]hydrazinyl]benzoic acid

Systemtic Name: 3-[(2E)-2-[(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)methylidene]hydrazinyl]benzoic acid Openeye Name: 3-[(2E)-2-[[1-phenyl-3-(2-thienyl)pyrazol-4-yl]methylene]hydrazino]benzoic acid CAS Name: 3-[(2E)-2-[(1-phenyl-3-thiophen-2-yl-4-pyrazolyl)methylidene]hydrazinyl]benzoic acid IUPAC Name: 3-[(2E)-2-[(1-phenyl-3-thiophen-2-ylpyrazol-4-yl)methylidene]hydrazinyl]benzoic acid Traditional Name: 3-[(N'E)-N'-[[1-phenyl-3-(2-thienyl)pyrazol-4-yl]methylene]hydrazino]benzoic acid Formula: C21H16N4O2S MolecularWeight: 388.44234

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=CS3)C=NNC4=CC=CC(=C4)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=CS3)/C=N/NC4=CC=CC(=C4)C(=O)O

InChI

InChI=1S/C21H16N4O2S/c26-21(27)15-6-4-7-17(12-15)23-22-13-16-14-25(18-8-2-1-3-9-18)24-20(16)19-10-5-11-28-19/h1-14,23H,(H,26,27)/b22-13+