6-methyl-N-[(4-pyrrolidin-1-ylcarbonylphenyl)methyl]-1-(thiophen-2-ylmethyl)pyrazolo[3,4-b]pyridine-4-carboxamide

Systemtic Name: 6-methyl-N-[(4-pyrrolidin-1-ylcarbonylphenyl)methyl]-1-(thiophen-2-ylmethyl)pyrazolo[3,4-b]pyridine-4-carboxamide Openeye Name: 6-methyl-N-[[4-(pyrrolidine-1-carbonyl)phenyl]methyl]-1-(2-thienylmethyl)pyrazolo[3,4-b]pyridine-4-carboxamide CAS Name: 6-methyl-N-[[4-[oxo(1-pyrrolidinyl)methyl]phenyl]methyl]-1-(thiophen-2-ylmethyl)-4-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: 6-methyl-N-[[4-(pyrrolidine-1-carbonyl)phenyl]methyl]-1-(thiophen-2-ylmethyl)pyrazolo[3,4-b]pyridine-4-carboxamide Traditional Name: 6-methyl-N-[4-(pyrrolidine-1-carbonyl)benzyl]-1-(2-thenyl)pyrazolo[3,4-b]pyridine-4-carboxamide Formula: C25H25N5O2S MolecularWeight: 459.5633

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=NN2CC3=CC=CS3)C(=C1)C(=O)NCC4=CC=C(C=C4)C(=O)N5CCCC5

Isomeric SMILES

CC1=NC2=C(C=NN2CC3=CC=CS3)C(=C1)C(=O)NCC4=CC=C(C=C4)C(=O)N5CCCC5

InChI

InChI=1S/C25H25N5O2S/c1-17-13-21(22-15-27-30(23(22)28-17)16-20-5-4-12-33-20)24(31)26-14-18-6-8-19(9-7-18)25(32)29-10-2-3-11-29/h4-9,12-13,15H,2-3,10-11,14,16H2,1H3,(H,26,31)