1,2-dimethyl-5-(3-nitrophenyl)sulfanyl-4-propan-2-yl-imidazole; 2-methyl-1,2-oxaziridin-3-one

Systemtic Name: 1,2-dimethyl-5-(3-nitrophenyl)sulfanyl-4-propan-2-yl-imidazole; 2-methyl-1,2-oxaziridin-3-one Openeye Name: 4-isopropyl-1,2-dimethyl-5-(3-nitrophenyl)sulfanyl-imidazole; 2-methyloxaziridin-3-one CAS Name: 1,2-dimethyl-5-[(3-nitrophenyl)thio]-4-propan-2-ylimidazole; 2-methyl-3-oxaziridinone IUPAC Name: 1,2-dimethyl-5-(3-nitrophenyl)sulfanyl-4-propan-2-ylimidazole; 2-methyloxaziridin-3-one Traditional Name: 4-isopropyl-1,2-dimethyl-5-[(3-nitrophenyl)thio]imidazole; 2-methyloxaziridin-3-one Formula: C16H20N4O4S MolecularWeight: 364.4194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(N1C)SC2=CC=CC(=C2)[N+](=O)[O-])C(C)C.CN1C(=O)O1

Isomeric SMILES

CC1=NC(=C(N1C)SC2=CC=CC(=C2)[N+](=O)[O-])C(C)C.CN1C(=O)O1

InChI

InChI=1S/C14H17N3O2S.C2H3NO2/c1-9(2)13-14(16(4)10(3)15-13)20-12-7-5-6-11(8-12)17(18)19;1-3-2(4)5-3/h5-9H,1-4H3;1H3