4-[(4-chlorophenyl)methylamino]-3-methyl-1-phenyl-N-(3-pyrrolidin-1-ylpropyl)pyrazolo[3,4-b]pyridine-5-carboxamide

Systemtic Name: 4-[(4-chlorophenyl)methylamino]-3-methyl-1-phenyl-N-(3-pyrrolidin-1-ylpropyl)pyrazolo[3,4-b]pyridine-5-carboxamide Openeye Name: 4-[(4-chlorophenyl)methylamino]-3-methyl-1-phenyl-N-(3-pyrrolidin-1-ylpropyl)pyrazolo[3,4-b]pyridine-5-carboxamide CAS Name: 4-[(4-chlorophenyl)methylamino]-3-methyl-1-phenyl-N-[3-(1-pyrrolidinyl)propyl]-5-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: 4-[(4-chlorophenyl)methylamino]-3-methyl-1-phenyl-N-(3-pyrrolidin-1-ylpropyl)pyrazolo[3,4-b]pyridine-5-carboxamide Traditional Name: 4-[(4-chlorobenzyl)amino]-3-methyl-1-phenyl-N-(3-pyrrolidinopropyl)pyrazolo[3,4-b]pyridine-5-carboxamide Formula: C28H31ClN6O MolecularWeight: 503.03834

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=NC=C(C(=C12)NCC3=CC=C(C=C3)Cl)C(=O)NCCCN4CCCC4)C5=CC=CC=C5

Isomeric SMILES

CC1=NN(C2=NC=C(C(=C12)NCC3=CC=C(C=C3)Cl)C(=O)NCCCN4CCCC4)C5=CC=CC=C5

InChI

InChI=1S/C28H31ClN6O/c1-20-25-26(31-18-21-10-12-22(29)13-11-21)24(28(36)30-14-7-17-34-15-5-6-16-34)19-32-27(25)35(33-20)23-8-3-2-4-9-23/h2-4,8-13,19H,5-7,14-18H2,1H3,(H,30,36)(H,31,32)