[2-[(4-bromophenyl)methyl-methyl-amino]-2-oxidanylidene-ethyl] 1-propan-2-ylpyrazolo[3,4-b]pyridine-5-carboxylate

Systemtic Name: [2-[(4-bromophenyl)methyl-methyl-amino]-2-oxidanylidene-ethyl] 1-propan-2-ylpyrazolo[3,4-b]pyridine-5-carboxylate Openeye Name: [2-[(4-bromophenyl)methyl-methyl-amino]-2-oxo-ethyl] 1-isopropylpyrazolo[3,4-b]pyridine-5-carboxylate CAS Name: 1-propan-2-yl-5-pyrazolo[3,4-b]pyridinecarboxylic acid [2-[(4-bromophenyl)methyl-methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(4-bromophenyl)methyl-methylamino]-2-oxoethyl] 1-propan-2-ylpyrazolo[3,4-b]pyridine-5-carboxylate Traditional Name: 1-isopropylpyrazolo[3,4-b]pyridine-5-carboxylic acid [2-[(4-bromobenzyl)-methyl-amino]-2-keto-ethyl] ester Formula: C20H21BrN4O3 MolecularWeight: 445.30974

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=NC=C(C=C2C=N1)C(=O)OCC(=O)N(C)CC3=CC=C(C=C3)Br

Isomeric SMILES

CC(C)N1C2=NC=C(C=C2C=N1)C(=O)OCC(=O)N(C)CC3=CC=C(C=C3)Br

InChI

InChI=1S/C20H21BrN4O3/c1-13(2)25-19-15(10-23-25)8-16(9-22-19)20(27)28-12-18(26)24(3)11-14-4-6-17(21)7-5-14/h4-10,13H,11-12H2,1-3H3