5-[5-(phenylmethyl)-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-yl]thiophene-2-carboxylic acid

Systemtic Name: 5-[5-(phenylmethyl)-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-yl]thiophene-2-carboxylic acid Openeye Name: 5-(5-benzyl-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-yl)thiophene-2-carboxylic acid CAS Name: 5-[5-(phenylmethyl)-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-yl]-2-thiophenecarboxylic acid IUPAC Name: 5-(5-benzyl-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-yl)thiophene-2-carboxylic acid Traditional Name: 5-(5-benzyl-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-yl)-2-thenoic acid Formula: C17H15N3O2S MolecularWeight: 325.3849

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(CN1CC3=CC=CC=C3)NN=C2C4=CC=C(S4)C(=O)O

Isomeric SMILES

C1C2=C(CN1CC3=CC=CC=C3)NN=C2C4=CC=C(S4)C(=O)O

InChI

InChI=1S/C17H15N3O2S/c21-17(22)15-7-6-14(23-15)16-12-9-20(10-13(12)18-19-16)8-11-4-2-1-3-5-11/h1-7H,8-10H2,(H,18,19)(H,21,22)