5-[(1-methylimidazol-2-yl)sulfanylmethyl]-3-(4-propan-2-ylphenyl)-1,2,4-oxadiazole

Systemtic Name: 5-[(1-methylimidazol-2-yl)sulfanylmethyl]-3-(4-propan-2-ylphenyl)-1,2,4-oxadiazole Openeye Name: 3-(4-isopropylphenyl)-5-[(1-methylimidazol-2-yl)sulfanylmethyl]-1,2,4-oxadiazole CAS Name: 5-[[(1-methyl-2-imidazolyl)thio]methyl]-3-(4-propan-2-ylphenyl)-1,2,4-oxadiazole IUPAC Name: 5-[(1-methylimidazol-2-yl)sulfanylmethyl]-3-(4-propan-2-ylphenyl)-1,2,4-oxadiazole Traditional Name: 5-[[(1-methylimidazol-2-yl)thio]methyl]-3-p-cumenyl-1,2,4-oxadiazole Formula: C16H18N4OS MolecularWeight: 314.40532

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=NOC(=N2)CSC3=NC=CN3C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=NOC(=N2)CSC3=NC=CN3C

InChI

InChI=1S/C16H18N4OS/c1-11(2)12-4-6-13(7-5-12)15-18-14(21-19-15)10-22-16-17-8-9-20(16)3/h4-9,11H,10H2,1-3H3