N-[3-(1-butylpiperidin-4-yl)-1H-pyrrolo[3,2-b]pyridin-5-yl]-4-fluoranyl-benzamide

Systemtic Name: N-[3-(1-butylpiperidin-4-yl)-1H-pyrrolo[3,2-b]pyridin-5-yl]-4-fluoranyl-benzamide Openeye Name: N-[3-(1-butyl-4-piperidyl)-1H-pyrrolo[3,2-b]pyridin-5-yl]-4-fluoro-benzamide CAS Name: N-[3-(1-butyl-4-piperidinyl)-1H-pyrrolo[3,2-b]pyridin-5-yl]-4-fluorobenzamide IUPAC Name: N-[3-(1-butylpiperidin-4-yl)-1H-pyrrolo[3,2-b]pyridin-5-yl]-4-fluorobenzamide Traditional Name: N-[3-(1-butyl-4-piperidyl)-1H-pyrrolo[3,2-b]pyridin-5-yl]-4-fluoro-benzamide Formula: C23H27FN4O MolecularWeight: 394.485083

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCC(CC1)C2=CNC3=C2N=C(C=C3)NC(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CCCCN1CCC(CC1)C2=CNC3=C2N=C(C=C3)NC(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H27FN4O/c1-2-3-12-28-13-10-16(11-14-28)19-15-25-20-8-9-21(26-22(19)20)27-23(29)17-4-6-18(24)7-5-17/h4-9,15-16,25H,2-3,10-14H2,1H3,(H,26,27,29)