4-[3-(propan-2-ylamino)pyridin-2-yl]-1-pyrrolo[2,3-b]pyridin-1-yl-piperazine-2-carbaldehyde

Systemtic Name: 4-[3-(propan-2-ylamino)pyridin-2-yl]-1-pyrrolo[2,3-b]pyridin-1-yl-piperazine-2-carbaldehyde Openeye Name: 4-[3-(isopropylamino)-2-pyridyl]-1-pyrrolo[2,3-b]pyridin-1-yl-piperazine-2-carbaldehyde CAS Name: 4-[3-(propan-2-ylamino)-2-pyridinyl]-1-(1-pyrrolo[2,3-b]pyridinyl)-2-piperazinecarboxaldehyde IUPAC Name: 4-[3-(propan-2-ylamino)pyridin-2-yl]-1-pyrrolo[2,3-b]pyridin-1-ylpiperazine-2-carbaldehyde Traditional Name: 4-[3-(isopropylamino)-2-pyridyl]-1-pyrrolo[2,3-b]pyridin-1-yl-piperazine-2-carbaldehyde Formula: C20H24N6O MolecularWeight: 364.44416

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=C(N=CC=C1)N2CCN(C(C2)C=O)N3C=CC4=C3N=CC=C4

Isomeric SMILES

CC(C)NC1=C(N=CC=C1)N2CCN(C(C2)C=O)N3C=CC4=C3N=CC=C4

InChI

InChI=1S/C20H24N6O/c1-15(2)23-18-6-4-9-22-20(18)24-11-12-25(17(13-24)14-27)26-10-7-16-5-3-8-21-19(16)26/h3-10,14-15,17,23H,11-13H2,1-2H3