4-[(1-aminocarbonylpiperidin-4-yl)amino]-1-ethyl-N-[(4-methylsulfonylphenyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide

Systemtic Name: 4-[(1-aminocarbonylpiperidin-4-yl)amino]-1-ethyl-N-[(4-methylsulfonylphenyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide Openeye Name: 4-[(1-carbamoyl-4-piperidyl)amino]-1-ethyl-N-[(4-methylsulfonylphenyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide CAS Name: 4-[(1-carbamoyl-4-piperidinyl)amino]-1-ethyl-N-[(4-methylsulfonylphenyl)methyl]-5-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: 4-[(1-carbamoylpiperidin-4-yl)amino]-1-ethyl-N-[(4-methylsulfonylphenyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide Traditional Name: 4-[(1-carbamoyl-4-piperidyl)amino]-1-ethyl-N-(4-mesylbenzyl)pyrazolo[3,4-b]pyridine-5-carboxamide Formula: C23H29N7O4S MolecularWeight: 499.58586

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=NC=C(C(=C2C=N1)NC3CCN(CC3)C(=O)N)C(=O)NCC4=CC=C(C=C4)S(=O)(=O)C

Isomeric SMILES

CCN1C2=NC=C(C(=C2C=N1)NC3CCN(CC3)C(=O)N)C(=O)NCC4=CC=C(C=C4)S(=O)(=O)C

InChI

InChI=1S/C23H29N7O4S/c1-3-30-21-18(14-27-30)20(28-16-8-10-29(11-9-16)23(24)32)19(13-25-21)22(31)26-12-15-4-6-17(7-5-15)35(2,33)34/h4-7,13-14,16H,3,8-12H2,1-2H3,(H2,24,32)(H,25,28)(H,26,31)