4-[3,5-bis(fluoranyl)phenyl]sulfanyl-5-propan-2-yl-1H-imidazole; butan-1-ol

Systemtic Name: 4-[3,5-bis(fluoranyl)phenyl]sulfanyl-5-propan-2-yl-1H-imidazole; butan-1-ol Openeye Name: butan-1-ol; 4-(3,5-difluorophenyl)sulfanyl-5-isopropyl-1H-imidazole CAS Name: 1-butanol; 4-[(3,5-difluorophenyl)thio]-5-propan-2-yl-1H-imidazole IUPAC Name: butan-1-ol; 4-(3,5-difluorophenyl)sulfanyl-5-propan-2-yl-1H-imidazole Traditional Name: butan-1-ol; 4-[(3,5-difluorophenyl)thio]-5-isopropyl-1H-imidazole Formula: C16H22F2N2OS MolecularWeight: 328.420486

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Descriptors Computed from Structure

Canonical SMILES:

CCCCO.CC(C)C1=C(N=CN1)SC2=CC(=CC(=C2)F)F

Isomeric SMILES

CCCCO.CC(C)C1=C(N=CN1)SC2=CC(=CC(=C2)F)F

InChI

InChI=1S/C12H12F2N2S.C4H10O/c1-7(2)11-12(16-6-15-11)17-10-4-8(13)3-9(14)5-10;1-2-3-4-5/h3-7H,1-2H3,(H,15,16);5H,2-4H2,1H3