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

Systemtic Name: 4-[[2-[(3-fluorophenyl)methylsulfanyl]imidazo[4,5-b]pyridin-3-yl]methyl]-N-(2-pyrrolidin-1-ylethyl)benzamide Openeye Name: 4-[[2-[(3-fluorophenyl)methylsulfanyl]imidazo[4,5-b]pyridin-3-yl]methyl]-N-(2-pyrrolidin-1-ylethyl)benzamide CAS Name: 4-[[2-[(3-fluorophenyl)methylthio]-3-imidazo[4,5-b]pyridinyl]methyl]-N-[2-(1-pyrrolidinyl)ethyl]benzamide IUPAC Name: 4-[[2-[(3-fluorophenyl)methylsulfanyl]imidazo[4,5-b]pyridin-3-yl]methyl]-N-(2-pyrrolidin-1-ylethyl)benzamide Traditional Name: 4-[[2-[(3-fluorobenzyl)thio]imidazo[4,5-b]pyridin-3-yl]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)CN3C4=C(C=CC=N4)N=C3SCC5=CC(=CC=C5)F

Isomeric SMILES

C1CCN(C1)CCNC(=O)C2=CC=C(C=C2)CN3C4=C(C=CC=N4)N=C3SCC5=CC(=CC=C5)F

InChI

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