4-[[3-[(4-fluorophenyl)methyl]imidazo[4,5-b]pyridin-2-yl]sulfanylmethyl]-N-(2-pyrrolidin-1-ylethyl)benzamide

Systemtic Name: 4-[[3-[(4-fluorophenyl)methyl]imidazo[4,5-b]pyridin-2-yl]sulfanylmethyl]-N-(2-pyrrolidin-1-ylethyl)benzamide Openeye Name: 4-[[3-[(4-fluorophenyl)methyl]imidazo[4,5-b]pyridin-2-yl]sulfanylmethyl]-N-(2-pyrrolidin-1-ylethyl)benzamide CAS Name: 4-[[[3-[(4-fluorophenyl)methyl]-2-imidazo[4,5-b]pyridinyl]thio]methyl]-N-[2-(1-pyrrolidinyl)ethyl]benzamide IUPAC Name: 4-[[3-[(4-fluorophenyl)methyl]imidazo[4,5-b]pyridin-2-yl]sulfanylmethyl]-N-(2-pyrrolidin-1-ylethyl)benzamide Traditional Name: 4-[[[3-(4-fluorobenzyl)imidazo[4,5-b]pyridin-2-yl]thio]methyl]-N-(2-pyrrolidinoethyl)benzamide Formula: C27H28FN5OS MolecularWeight: 489.607523

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCNC(=O)C2=CC=C(C=C2)CSC3=NC4=C(N3CC5=CC=C(C=C5)F)N=CC=C4

Isomeric SMILES

C1CCN(C1)CCNC(=O)C2=CC=C(C=C2)CSC3=NC4=C(N3CC5=CC=C(C=C5)F)N=CC=C4

InChI

InChI=1S/C27H28FN5OS/c28-23-11-7-20(8-12-23)18-33-25-24(4-3-13-29-25)31-27(33)35-19-21-5-9-22(10-6-21)26(34)30-14-17-32-15-1-2-16-32/h3-13H,1-2,14-19H2,(H,30,34)