4-(1-azanylethyl)-3-(3-methoxyphenyl)-N-(1H-pyrazolo[3,4-b]pyridin-4-yl)benzamide

Systemtic Name: 4-(1-azanylethyl)-3-(3-methoxyphenyl)-N-(1H-pyrazolo[3,4-b]pyridin-4-yl)benzamide Openeye Name: 4-(1-aminoethyl)-3-(3-methoxyphenyl)-N-(1H-pyrazolo[3,4-b]pyridin-4-yl)benzamide CAS Name: 4-(1-aminoethyl)-3-(3-methoxyphenyl)-N-(1H-pyrazolo[3,4-b]pyridin-4-yl)benzamide IUPAC Name: 4-(1-aminoethyl)-3-(3-methoxyphenyl)-N-(1H-pyrazolo[3,4-b]pyridin-4-yl)benzamide Traditional Name: 4-(1-aminoethyl)-3-(3-methoxyphenyl)-N-(1H-pyrazolo[3,4-b]pyridin-4-yl)benzamide Formula: C22H21N5O2 MolecularWeight: 387.43444

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=C(C=C1)C(=O)NC2=C3C=NNC3=NC=C2)C4=CC(=CC=C4)OC)N

Isomeric SMILES

CC(C1=C(C=C(C=C1)C(=O)NC2=C3C=NNC3=NC=C2)C4=CC(=CC=C4)OC)N

InChI

InChI=1S/C22H21N5O2/c1-13(23)17-7-6-15(11-18(17)14-4-3-5-16(10-14)29-2)22(28)26-20-8-9-24-21-19(20)12-25-27-21/h3-13H,23H2,1-2H3,(H2,24,25,26,27,28)