3-[3,4-bis(fluoranyl)phenyl]-1-butyl-4-imidazol-1-yl-5-methylsulfanyl-pyrazole

Systemtic Name: 3-[3,4-bis(fluoranyl)phenyl]-1-butyl-4-imidazol-1-yl-5-methylsulfanyl-pyrazole Openeye Name: 1-butyl-3-(3,4-difluorophenyl)-4-imidazol-1-yl-5-methylsulfanyl-pyrazole CAS Name: 1-butyl-3-(3,4-difluorophenyl)-4-(1-imidazolyl)-5-(methylthio)pyrazole IUPAC Name: 1-butyl-3-(3,4-difluorophenyl)-4-imidazol-1-yl-5-methylsulfanylpyrazole Traditional Name: 1-butyl-3-(3,4-difluorophenyl)-4-imidazol-1-yl-5-(methylthio)pyrazole Formula: C17H18F2N4S MolecularWeight: 348.413426

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=N1)C2=CC(=C(C=C2)F)F)N3C=CN=C3)SC

Isomeric SMILES

CCCCN1C(=C(C(=N1)C2=CC(=C(C=C2)F)F)N3C=CN=C3)SC

InChI

InChI=1S/C17H18F2N4S/c1-3-4-8-23-17(24-2)16(22-9-7-20-11-22)15(21-23)12-5-6-13(18)14(19)10-12/h5-7,9-11H,3-4,8H2,1-2H3