5-[1-(phenylmethyl)thieno[3,2-c]pyrazol-3-yl]furan-2-carboxylic acid

Systemtic Name: 5-[1-(phenylmethyl)thieno[3,2-c]pyrazol-3-yl]furan-2-carboxylic acid Openeye Name: 5-(1-benzylthieno[3,2-c]pyrazol-3-yl)furan-2-carboxylic acid CAS Name: 5-[1-(phenylmethyl)-3-thieno[3,2-c]pyrazolyl]-2-furancarboxylic acid IUPAC Name: 5-(1-benzylthieno[3,2-c]pyrazol-3-yl)furan-2-carboxylic acid Traditional Name: 5-(1-benzylthieno[3,2-c]pyrazol-3-yl)-2-furoic acid Formula: C17H12N2O3S MolecularWeight: 324.35378

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=C(C(=N2)C4=CC=C(O4)C(=O)O)SC=C3

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=C(C(=N2)C4=CC=C(O4)C(=O)O)SC=C3

InChI

InChI=1S/C17H12N2O3S/c20-17(21)14-7-6-13(22-14)15-16-12(8-9-23-16)19(18-15)10-11-4-2-1-3-5-11/h1-9H,10H2,(H,20,21)