3-(3-thiophen-2-yl-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazol-1-yl)benzoic acid

Systemtic Name: 3-(3-thiophen-2-yl-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazol-1-yl)benzoic acid Openeye Name: 3-[3-(2-thienyl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazol-1-yl]benzoic acid CAS Name: 3-(3-thiophen-2-yl-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazol-1-yl)benzoic acid IUPAC Name: 3-(3-thiophen-2-yl-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazol-1-yl)benzoic acid Traditional Name: 3-[3-(2-thienyl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazol-1-yl]benzoic acid Formula: C16H13N3O2S MolecularWeight: 311.35832

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Descriptors Computed from Structure

Canonical SMILES:

C1CN=C2C1=C(NN2C3=CC=CC(=C3)C(=O)O)C4=CC=CS4

Isomeric SMILES

C1CN=C2C1=C(NN2C3=CC=CC(=C3)C(=O)O)C4=CC=CS4

InChI

InChI=1S/C16H13N3O2S/c20-16(21)10-3-1-4-11(9-10)19-15-12(6-7-17-15)14(18-19)13-5-2-8-22-13/h1-5,8-9,18H,6-7H2,(H,20,21)