2-[4,6-dimethyl-1-(thiophen-3-ylmethyl)pyrazolo[3,4-b]pyridin-5-yl]ethanoic acid

Systemtic Name: 2-[4,6-dimethyl-1-(thiophen-3-ylmethyl)pyrazolo[3,4-b]pyridin-5-yl]ethanoic acid Openeye Name: 2-[4,6-dimethyl-1-(3-thienylmethyl)pyrazolo[3,4-b]pyridin-5-yl]acetic acid CAS Name: 2-[4,6-dimethyl-1-(3-thiophenylmethyl)-5-pyrazolo[3,4-b]pyridinyl]acetic acid IUPAC Name: 2-[4,6-dimethyl-1-(thiophen-3-ylmethyl)pyrazolo[3,4-b]pyridin-5-yl]acetic acid Traditional Name: 2-[4,6-dimethyl-1-(3-thenyl)pyrazolo[3,4-b]pyridin-5-yl]acetic acid Formula: C15H15N3O2S MolecularWeight: 301.3635

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=NN(C2=NC(=C1CC(=O)O)C)CC3=CSC=C3

Isomeric SMILES

CC1=C2C=NN(C2=NC(=C1CC(=O)O)C)CC3=CSC=C3

InChI

InChI=1S/C15H15N3O2S/c1-9-12(5-14(19)20)10(2)17-15-13(9)6-16-18(15)7-11-3-4-21-8-11/h3-4,6,8H,5,7H2,1-2H3,(H,19,20)