[2-ethyl-4-(1H-pyrrolo[2,3-b]pyridin-3-ylcarbonyl)piperazin-1-yl]-phenyl-methanone

Systemtic Name: [2-ethyl-4-(1H-pyrrolo[2,3-b]pyridin-3-ylcarbonyl)piperazin-1-yl]-phenyl-methanone Openeye Name: [2-ethyl-4-(1H-pyrrolo[2,3-b]pyridine-3-carbonyl)piperazin-1-yl]-phenyl-methanone CAS Name: [2-ethyl-4-[oxo(1H-pyrrolo[2,3-b]pyridin-3-yl)methyl]-1-piperazinyl]-phenylmethanone IUPAC Name: [2-ethyl-4-(1H-pyrrolo[2,3-b]pyridine-3-carbonyl)piperazin-1-yl]-phenylmethanone Traditional Name: [2-ethyl-4-(1H-pyrrolo[2,3-b]pyridine-3-carbonyl)piperazino]-phenyl-methanone Formula: C21H22N4O2 MolecularWeight: 362.42498

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CN(CCN1C(=O)C2=CC=CC=C2)C(=O)C3=CNC4=C3C=CC=N4

Isomeric SMILES

CCC1CN(CCN1C(=O)C2=CC=CC=C2)C(=O)C3=CNC4=C3C=CC=N4

InChI

InChI=1S/C21H22N4O2/c1-2-16-14-24(11-12-25(16)20(26)15-7-4-3-5-8-15)21(27)18-13-23-19-17(18)9-6-10-22-19/h3-10,13,16H,2,11-12,14H2,1H3,(H,22,23)