1-[(2S,3R)-3-fluoranylbutan-2-yl]-6-methoxy-4-piperazin-1-yl-benzimidazole

Systemtic Name: 1-[(2S,3R)-3-fluoranylbutan-2-yl]-6-methoxy-4-piperazin-1-yl-benzimidazole Openeye Name: 1-[(1S,2R)-2-fluoro-1-methyl-propyl]-6-methoxy-4-piperazin-1-yl-benzimidazole CAS Name: 1-[(2S,3R)-3-fluorobutan-2-yl]-6-methoxy-4-(1-piperazinyl)benzimidazole IUPAC Name: 1-[(2S,3R)-3-fluorobutan-2-yl]-6-methoxy-4-piperazin-1-ylbenzimidazole Traditional Name: 1-[(1S,2R)-2-fluoro-1-methyl-propyl]-6-methoxy-4-piperazino-benzimidazole Formula: C16H23FN4O MolecularWeight: 306.378423

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C)F)N1C=NC2=C(C=C(C=C21)OC)N3CCNCC3

Isomeric SMILES

C[C@@H]([C@@H](C)F)N1C=NC2=C(C=C(C=C21)OC)N3CCNCC3

InChI

InChI=1S/C16H23FN4O/c1-11(17)12(2)21-10-19-16-14(20-6-4-18-5-7-20)8-13(22-3)9-15(16)21/h8-12,18H,4-7H2,1-3H3/t11-,12+/m1/s1