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

Systemtic Name: 3-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-5-methyl-1,2-oxazole Openeye Name: 3-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-5-methyl-isoxazole CAS Name: 3-[[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)thio]methyl]-5-methylisoxazole IUPAC Name: 3-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-5-methyl-1,2-oxazole Traditional Name: 3-[[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)thio]methyl]-5-methyl-isoxazole Formula: C16H16N4OS MolecularWeight: 312.38944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)CSC2=NN=C(N2C3=CC=CC=C3)C4CC4

Isomeric SMILES

CC1=CC(=NO1)CSC2=NN=C(N2C3=CC=CC=C3)C4CC4

InChI

InChI=1S/C16H16N4OS/c1-11-9-13(19-21-11)10-22-16-18-17-15(12-7-8-12)20(16)14-5-3-2-4-6-14/h2-6,9,12H,7-8,10H2,1H3