5-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-3-methyl-1,2-oxazole

Systemtic Name: 5-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-3-methyl-1,2-oxazole Openeye Name: 5-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-3-methyl-isoxazole CAS Name: 5-[[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)thio]methyl]-3-methylisoxazole IUPAC Name: 5-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-3-methyl-1,2-oxazole Traditional Name: 5-[[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)thio]methyl]-3-methyl-isoxazole Formula: C12H16N4OS MolecularWeight: 264.34664

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2=CC(=NO2)C)C3CC3

Isomeric SMILES

CCN1C(=NN=C1SCC2=CC(=NO2)C)C3CC3

InChI

InChI=1S/C12H16N4OS/c1-3-16-11(9-4-5-9)13-14-12(16)18-7-10-6-8(2)15-17-10/h6,9H,3-5,7H2,1-2H3