5-(1,4-diazabicyclo[3.2.1]octan-4-yl)-6-fluoranyl-2-pentan-3-ylsulfanyl-1H-benzimidazole

Systemtic Name: 5-(1,4-diazabicyclo[3.2.1]octan-4-yl)-6-fluoranyl-2-pentan-3-ylsulfanyl-1H-benzimidazole Openeye Name: 5-(1,4-diazabicyclo[3.2.1]octan-4-yl)-2-(1-ethylpropylsulfanyl)-6-fluoro-1H-benzimidazole CAS Name: 5-(1,4-diazabicyclo[3.2.1]octan-4-yl)-6-fluoro-2-(pentan-3-ylthio)-1H-benzimidazole IUPAC Name: 5-(1,4-diazabicyclo[3.2.1]octan-4-yl)-6-fluoro-2-pentan-3-ylsulfanyl-1H-benzimidazole Traditional Name: 5-(1,4-diazabicyclo[3.2.1]octan-4-yl)-2-(1-ethylpropylthio)-6-fluoro-1H-benzimidazole Formula: C18H25FN4S MolecularWeight: 348.481303

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)SC1=NC2=CC(=C(C=C2N1)F)N3CCN4CCC3C4

Isomeric SMILES

CCC(CC)SC1=NC2=CC(=C(C=C2N1)F)N3CCN4CCC3C4

InChI

InChI=1S/C18H25FN4S/c1-3-13(4-2)24-18-20-15-9-14(19)17(10-16(15)21-18)23-8-7-22-6-5-12(23)11-22/h9-10,12-13H,3-8,11H2,1-2H3,(H,20,21)