2-[6-(1H-pyrrolo[2,3-b]pyridin-3-yl)pyrimidin-4-yl]-3,4-dihydro-1H-isoquinoline

Systemtic Name: 2-[6-(1H-pyrrolo[2,3-b]pyridin-3-yl)pyrimidin-4-yl]-3,4-dihydro-1H-isoquinoline Openeye Name: 2-[6-(1H-pyrrolo[2,3-b]pyridin-3-yl)pyrimidin-4-yl]-3,4-dihydro-1H-isoquinoline CAS Name: 2-[6-(1H-pyrrolo[2,3-b]pyridin-3-yl)-4-pyrimidinyl]-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-[6-(1H-pyrrolo[2,3-b]pyridin-3-yl)pyrimidin-4-yl]-3,4-dihydro-1H-isoquinoline Traditional Name: 2-[6-(1H-pyrrolo[2,3-b]pyridin-3-yl)pyrimidin-4-yl]-3,4-dihydro-1H-isoquinoline Formula: C20H17N5 MolecularWeight: 327.38248

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C3=NC=NC(=C3)C4=CNC5=C4C=CC=N5

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C3=NC=NC(=C3)C4=CNC5=C4C=CC=N5

InChI

InChI=1S/C20H17N5/c1-2-5-15-12-25(9-7-14(15)4-1)19-10-18(23-13-24-19)17-11-22-20-16(17)6-3-8-21-20/h1-6,8,10-11,13H,7,9,12H2,(H,21,22)