1,3,6-trimethyl-N-[(4-morpholin-4-ylsulfonylphenyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide

Systemtic Name: 1,3,6-trimethyl-N-[(4-morpholin-4-ylsulfonylphenyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide Openeye Name: 1,3,6-trimethyl-N-[(4-morpholinosulfonylphenyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide CAS Name: 1,3,6-trimethyl-N-[[4-(4-morpholinylsulfonyl)phenyl]methyl]-5-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: 1,3,6-trimethyl-N-[(4-morpholin-4-ylsulfonylphenyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide Traditional Name: 1,3,6-trimethyl-N-(4-morpholinosulfonylbenzyl)pyrazolo[3,4-b]pyridine-5-carboxamide Formula: C21H25N5O4S MolecularWeight: 443.5193

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=NN(C2=N1)C)C)C(=O)NCC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CC1=C(C=C2C(=NN(C2=N1)C)C)C(=O)NCC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C21H25N5O4S/c1-14-19(12-18-15(2)24-25(3)20(18)23-14)21(27)22-13-16-4-6-17(7-5-16)31(28,29)26-8-10-30-11-9-26/h4-7,12H,8-11,13H2,1-3H3,(H,22,27)