[4-(1,3-dithiolan-2-yl)-2-methoxy-phenyl] 1-propan-2-ylpyrazolo[3,4-b]pyridine-5-carboxylate

Systemtic Name: [4-(1,3-dithiolan-2-yl)-2-methoxy-phenyl] 1-propan-2-ylpyrazolo[3,4-b]pyridine-5-carboxylate Openeye Name: [4-(1,3-dithiolan-2-yl)-2-methoxy-phenyl] 1-isopropylpyrazolo[3,4-b]pyridine-5-carboxylate CAS Name: 1-propan-2-yl-5-pyrazolo[3,4-b]pyridinecarboxylic acid [4-(1,3-dithiolan-2-yl)-2-methoxyphenyl] ester IUPAC Name: [4-(1,3-dithiolan-2-yl)-2-methoxyphenyl] 1-propan-2-ylpyrazolo[3,4-b]pyridine-5-carboxylate Traditional Name: 1-isopropylpyrazolo[3,4-b]pyridine-5-carboxylic acid [4-(1,3-dithiolan-2-yl)-2-methoxy-phenyl] ester Formula: C20H21N3O3S2 MolecularWeight: 415.52904

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=NC=C(C=C2C=N1)C(=O)OC3=C(C=C(C=C3)C4SCCS4)OC

Isomeric SMILES

CC(C)N1C2=NC=C(C=C2C=N1)C(=O)OC3=C(C=C(C=C3)C4SCCS4)OC

InChI

InChI=1S/C20H21N3O3S2/c1-12(2)23-18-14(11-22-23)8-15(10-21-18)19(24)26-16-5-4-13(9-17(16)25-3)20-27-6-7-28-20/h4-5,8-12,20H,6-7H2,1-3H3