4-[5-(1-benzothiophen-2-yl)-1H-pyrazol-3-yl]benzoic acid

Systemtic Name: 4-[5-(1-benzothiophen-2-yl)-1H-pyrazol-3-yl]benzoic acid Openeye Name: 4-[5-(benzothiophen-2-yl)-1H-pyrazol-3-yl]benzoic acid CAS Name: 4-[5-(1-benzothiophen-2-yl)-1H-pyrazol-3-yl]benzoic acid IUPAC Name: 4-[5-(1-benzothiophen-2-yl)-1H-pyrazol-3-yl]benzoic acid Traditional Name: 4-[5-(benzothiophen-2-yl)-1H-pyrazol-3-yl]benzoic acid Formula: C18H12N2O2S MolecularWeight: 320.36508

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(S2)C3=CC(=NN3)C4=CC=C(C=C4)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=C(S2)C3=CC(=NN3)C4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C18H12N2O2S/c21-18(22)12-7-5-11(6-8-12)14-10-15(20-19-14)17-9-13-3-1-2-4-16(13)23-17/h1-10H,(H,19,20)(H,21,22)