3-(1-benzofuran-2-yl)-3-[4-(1H-pyrrolo[2,3-b]pyridin-4-yl)pyrazol-1-yl]propanenitrile

Systemtic Name: 3-(1-benzofuran-2-yl)-3-[4-(1H-pyrrolo[2,3-b]pyridin-4-yl)pyrazol-1-yl]propanenitrile Openeye Name: 3-(benzofuran-2-yl)-3-[4-(1H-pyrrolo[2,3-b]pyridin-4-yl)pyrazol-1-yl]propanenitrile CAS Name: 3-(2-benzofuranyl)-3-[4-(1H-pyrrolo[2,3-b]pyridin-4-yl)-1-pyrazolyl]propanenitrile IUPAC Name: 3-(1-benzofuran-2-yl)-3-[4-(1H-pyrrolo[2,3-b]pyridin-4-yl)pyrazol-1-yl]propanenitrile Traditional Name: 3-(benzofuran-2-yl)-3-[4-(1H-pyrrolo[2,3-b]pyridin-4-yl)pyrazol-1-yl]propionitrile Formula: C21H15N5O MolecularWeight: 353.3767

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(O2)C(CC#N)N3C=C(C=N3)C4=C5C=CNC5=NC=C4

Isomeric SMILES

C1=CC=C2C(=C1)C=C(O2)C(CC#N)N3C=C(C=N3)C4=C5C=CNC5=NC=C4

InChI

InChI=1S/C21H15N5O/c22-8-5-18(20-11-14-3-1-2-4-19(14)27-20)26-13-15(12-25-26)16-6-9-23-21-17(16)7-10-24-21/h1-4,6-7,9-13,18H,5H2,(H,23,24)