4-isocyano-5-(4-methylphenyl)-3-methylsulfanyl-1,2-oxazole

Systemtic Name: 4-isocyano-5-(4-methylphenyl)-3-methylsulfanyl-1,2-oxazole Openeye Name: 4-isocyano-3-methylsulfanyl-5-(p-tolyl)isoxazole CAS Name: 4-isocyano-5-(4-methylphenyl)-3-(methylthio)isoxazole IUPAC Name: 4-isocyano-5-(4-methylphenyl)-3-methylsulfanyl-1,2-oxazole Traditional Name: 4-isocyano-3-(methylthio)-5-(p-tolyl)isoxazole Formula: C12H10N2OS MolecularWeight: 230.2856

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C(=NO2)SC)[N+]#[C-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C(=NO2)SC)[N+]#[C-]

InChI

InChI=1S/C12H10N2OS/c1-8-4-6-9(7-5-8)11-10(13-2)12(16-3)14-15-11/h4-7H,1,3H3