3-[4-(4-methyl-1H-pyrrolo[2,3-b]pyridin-5-yl)piperazin-1-yl]isoquinoline

Systemtic Name: 3-[4-(4-methyl-1H-pyrrolo[2,3-b]pyridin-5-yl)piperazin-1-yl]isoquinoline Openeye Name: 3-[4-(4-methyl-1H-pyrrolo[2,3-b]pyridin-5-yl)piperazin-1-yl]isoquinoline CAS Name: 3-[4-(4-methyl-1H-pyrrolo[2,3-b]pyridin-5-yl)-1-piperazinyl]isoquinoline IUPAC Name: 3-[4-(4-methyl-1H-pyrrolo[2,3-b]pyridin-5-yl)piperazin-1-yl]isoquinoline Traditional Name: 3-[4-(4-methyl-1H-pyrrolo[2,3-b]pyridin-5-yl)piperazino]isoquinoline Formula: C21H21N5 MolecularWeight: 343.42494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=CNC2=NC=C1N3CCN(CC3)C4=CC5=CC=CC=C5C=N4

Isomeric SMILES

CC1=C2C=CNC2=NC=C1N3CCN(CC3)C4=CC5=CC=CC=C5C=N4

InChI

InChI=1S/C21H21N5/c1-15-18-6-7-22-21(18)24-14-19(15)25-8-10-26(11-9-25)20-12-16-4-2-3-5-17(16)13-23-20/h2-7,12-14H,8-11H2,1H3,(H,22,24)