5-[3,5-bis(fluoranyl)phenyl]sulfanyl-1-butyl-2-methyl-4-propan-2-yl-imidazole; 1,2-oxaziridin-3-one

Systemtic Name: 5-[3,5-bis(fluoranyl)phenyl]sulfanyl-1-butyl-2-methyl-4-propan-2-yl-imidazole; 1,2-oxaziridin-3-one Openeye Name: 1-butyl-5-(3,5-difluorophenyl)sulfanyl-4-isopropyl-2-methyl-imidazole; oxaziridin-3-one CAS Name: 1-butyl-5-[(3,5-difluorophenyl)thio]-2-methyl-4-propan-2-ylimidazole; 3-oxaziridinone IUPAC Name: 1-butyl-5-(3,5-difluorophenyl)sulfanyl-2-methyl-4-propan-2-ylimidazole; oxaziridin-3-one Traditional Name: 1-butyl-5-[(3,5-difluorophenyl)thio]-4-isopropyl-2-methyl-imidazole; oxaziridin-3-one Formula: C18H23F2N3O2S MolecularWeight: 383.455926

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NC(=C1SC2=CC(=CC(=C2)F)F)C(C)C)C.C1(=O)NO1

Isomeric SMILES

CCCCN1C(=NC(=C1SC2=CC(=CC(=C2)F)F)C(C)C)C.C1(=O)NO1

InChI

InChI=1S/C17H22F2N2S.CHNO2/c1-5-6-7-21-12(4)20-16(11(2)3)17(21)22-15-9-13(18)8-14(19)10-15;3-1-2-4-1/h8-11H,5-7H2,1-4H3;(H,2,3)