3-[3-(cyclohexen-1-yl)-2H-pyrazolo[3,4-b]pyridin-5-yl]-N,N-dimethyl-benzamide

Systemtic Name: 3-[3-(cyclohexen-1-yl)-2H-pyrazolo[3,4-b]pyridin-5-yl]-N,N-dimethyl-benzamide Openeye Name: 3-[3-(cyclohexen-1-yl)-2H-pyrazolo[3,4-b]pyridin-5-yl]-N,N-dimethyl-benzamide CAS Name: 3-[3-(1-cyclohexenyl)-2H-pyrazolo[3,4-b]pyridin-5-yl]-N,N-dimethylbenzamide IUPAC Name: 3-[3-(cyclohexen-1-yl)-2H-pyrazolo[3,4-b]pyridin-5-yl]-N,N-dimethylbenzamide Traditional Name: 3-[3-(cyclohexen-1-yl)-2H-pyrazolo[3,4-b]pyridin-5-yl]-N,N-dimethyl-benzamide Formula: C21H22N4O MolecularWeight: 346.42558

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C1=CC=CC(=C1)C2=CC3=C(NN=C3N=C2)C4=CCCCC4

Isomeric SMILES

CN(C)C(=O)C1=CC=CC(=C1)C2=CC3=C(NN=C3N=C2)C4=CCCCC4

InChI

InChI=1S/C21H22N4O/c1-25(2)21(26)16-10-6-9-15(11-16)17-12-18-19(14-7-4-3-5-8-14)23-24-20(18)22-13-17/h6-7,9-13H,3-5,8H2,1-2H3,(H,22,23,24)