[2-[bis(2-methoxyethyl)amino]-2-oxidanylidene-ethyl] 3-methyl-1-phenyl-6-thiophen-2-yl-pyrazolo[3,4-b]pyridine-4-carboxylate

Systemtic Name: [2-[bis(2-methoxyethyl)amino]-2-oxidanylidene-ethyl] 3-methyl-1-phenyl-6-thiophen-2-yl-pyrazolo[3,4-b]pyridine-4-carboxylate Openeye Name: [2-[bis(2-methoxyethyl)amino]-2-oxo-ethyl] 3-methyl-1-phenyl-6-(2-thienyl)pyrazolo[3,4-b]pyridine-4-carboxylate CAS Name: 3-methyl-1-phenyl-6-thiophen-2-yl-4-pyrazolo[3,4-b]pyridinecarboxylic acid [2-[bis(2-methoxyethyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[bis(2-methoxyethyl)amino]-2-oxoethyl] 3-methyl-1-phenyl-6-thiophen-2-ylpyrazolo[3,4-b]pyridine-4-carboxylate Traditional Name: 3-methyl-1-phenyl-6-(2-thienyl)pyrazolo[3,4-b]pyridine-4-carboxylic acid [2-[bis(2-methoxyethyl)amino]-2-keto-ethyl] ester Formula: C26H28N4O5S MolecularWeight: 508.58932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=CC(=N2)C3=CC=CS3)C(=O)OCC(=O)N(CCOC)CCOC)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C2=C1C(=CC(=N2)C3=CC=CS3)C(=O)OCC(=O)N(CCOC)CCOC)C4=CC=CC=C4

InChI

InChI=1S/C26H28N4O5S/c1-18-24-20(26(32)35-17-23(31)29(11-13-33-2)12-14-34-3)16-21(22-10-7-15-36-22)27-25(24)30(28-18)19-8-5-4-6-9-19/h4-10,15-16H,11-14,17H2,1-3H3