[4-(5-chloranyl-3-pyridin-3-yl-1H-pyrrolo[2,3-b]pyridin-2-yl)-1H-pyrrol-2-yl]-piperazin-1-yl-methanone

Systemtic Name: [4-(5-chloranyl-3-pyridin-3-yl-1H-pyrrolo[2,3-b]pyridin-2-yl)-1H-pyrrol-2-yl]-piperazin-1-yl-methanone Openeye Name: [4-[5-chloro-3-(3-pyridyl)-1H-pyrrolo[2,3-b]pyridin-2-yl]-1H-pyrrol-2-yl]-piperazin-1-yl-methanone CAS Name: [4-[5-chloro-3-(3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-2-yl]-1H-pyrrol-2-yl]-(1-piperazinyl)methanone IUPAC Name: [4-(5-chloro-3-pyridin-3-yl-1H-pyrrolo[2,3-b]pyridin-2-yl)-1H-pyrrol-2-yl]-piperazin-1-ylmethanone Traditional Name: [4-[5-chloro-3-(3-pyridyl)-1H-pyrrolo[2,3-b]pyridin-2-yl]-1H-pyrrol-2-yl]-piperazino-methanone Formula: C21H19ClN6O MolecularWeight: 406.86816

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C(=O)C2=CC(=CN2)C3=C(C4=CC(=CN=C4N3)Cl)C5=CN=CC=C5

Isomeric SMILES

C1CN(CCN1)C(=O)C2=CC(=CN2)C3=C(C4=CC(=CN=C4N3)Cl)C5=CN=CC=C5

InChI

InChI=1S/C21H19ClN6O/c22-15-9-16-18(13-2-1-3-24-10-13)19(27-20(16)26-12-15)14-8-17(25-11-14)21(29)28-6-4-23-5-7-28/h1-3,8-12,23,25H,4-7H2,(H,26,27)