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

Systemtic Name: 5-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-3-(4-propan-2-ylphenyl)-1,2,4-oxadiazole Openeye Name: 5-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-3-(4-isopropylphenyl)-1,2,4-oxadiazole CAS Name: 5-[[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)thio]methyl]-3-(4-propan-2-ylphenyl)-1,2,4-oxadiazole IUPAC Name: 5-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-3-(4-propan-2-ylphenyl)-1,2,4-oxadiazole Traditional Name: 5-[[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)thio]methyl]-3-p-cumenyl-1,2,4-oxadiazole Formula: C23H23N5OS MolecularWeight: 417.52662

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=NOC(=N2)CSC3=NN=C(N3C4=CC=CC=C4)C5CC5

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=NOC(=N2)CSC3=NN=C(N3C4=CC=CC=C4)C5CC5

InChI

InChI=1S/C23H23N5OS/c1-15(2)16-8-10-17(11-9-16)21-24-20(29-27-21)14-30-23-26-25-22(18-12-13-18)28(23)19-6-4-3-5-7-19/h3-11,15,18H,12-14H2,1-2H3