N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)-1-(phenylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide

Systemtic Name: N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)-1-(phenylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide Openeye Name: 1-benzyl-N-(2-morpholino-1,3-benzothiazol-6-yl)pyrazolo[3,4-b]pyridine-5-carboxamide CAS Name: N-[2-(4-morpholinyl)-1,3-benzothiazol-6-yl]-1-(phenylmethyl)-5-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: 1-benzyl-N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)pyrazolo[3,4-b]pyridine-5-carboxamide Traditional Name: 1-benzyl-N-(2-morpholino-1,3-benzothiazol-6-yl)pyrazolo[3,4-b]pyridine-5-carboxamide Formula: C25H22N6O2S MolecularWeight: 470.54618

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC3=C(S2)C=C(C=C3)NC(=O)C4=CN=C5C(=C4)C=NN5CC6=CC=CC=C6

Isomeric SMILES

C1COCCN1C2=NC3=C(S2)C=C(C=C3)NC(=O)C4=CN=C5C(=C4)C=NN5CC6=CC=CC=C6

InChI

InChI=1S/C25H22N6O2S/c32-24(19-12-18-15-27-31(23(18)26-14-19)16-17-4-2-1-3-5-17)28-20-6-7-21-22(13-20)34-25(29-21)30-8-10-33-11-9-30/h1-7,12-15H,8-11,16H2,(H,28,32)