[2-[(3-fluoranyl-2-methyl-phenyl)methyl]-1-phenyl-pyrrolo[3,2-b]pyridin-3-yl]-piperazin-1-yl-methanone

Systemtic Name: [2-[(3-fluoranyl-2-methyl-phenyl)methyl]-1-phenyl-pyrrolo[3,2-b]pyridin-3-yl]-piperazin-1-yl-methanone Openeye Name: [2-[(3-fluoro-2-methyl-phenyl)methyl]-1-phenyl-pyrrolo[3,2-b]pyridin-3-yl]-piperazin-1-yl-methanone CAS Name: [2-[(3-fluoro-2-methylphenyl)methyl]-1-phenyl-3-pyrrolo[3,2-b]pyridinyl]-(1-piperazinyl)methanone IUPAC Name: [2-[(3-fluoro-2-methylphenyl)methyl]-1-phenylpyrrolo[3,2-b]pyridin-3-yl]-piperazin-1-ylmethanone Traditional Name: [2-(3-fluoro-2-methyl-benzyl)-1-phenyl-pyrrolo[3,2-b]pyridin-3-yl]-piperazino-methanone Formula: C26H25FN4O MolecularWeight: 428.501303

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1F)CC2=C(C3=C(N2C4=CC=CC=C4)C=CC=N3)C(=O)N5CCNCC5

Isomeric SMILES

CC1=C(C=CC=C1F)CC2=C(C3=C(N2C4=CC=CC=C4)C=CC=N3)C(=O)N5CCNCC5

InChI

InChI=1S/C26H25FN4O/c1-18-19(7-5-10-21(18)27)17-23-24(26(32)30-15-13-28-14-16-30)25-22(11-6-12-29-25)31(23)20-8-3-2-4-9-20/h2-12,28H,13-17H2,1H3