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

Systemtic Name: 3-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-5-(4-methylphenyl)-1,2,4-oxadiazole Openeye Name: 3-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-5-(p-tolyl)-1,2,4-oxadiazole CAS Name: 3-[[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)thio]methyl]-5-(4-methylphenyl)-1,2,4-oxadiazole IUPAC Name: 3-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-5-(4-methylphenyl)-1,2,4-oxadiazole Traditional Name: 3-[[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)thio]methyl]-5-(p-tolyl)-1,2,4-oxadiazole Formula: C21H19N5OS MolecularWeight: 389.47346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=NO2)CSC3=NN=C(N3C4=CC=CC=C4)C5CC5

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=NO2)CSC3=NN=C(N3C4=CC=CC=C4)C5CC5

InChI

InChI=1S/C21H19N5OS/c1-14-7-9-16(10-8-14)20-22-18(25-27-20)13-28-21-24-23-19(15-11-12-15)26(21)17-5-3-2-4-6-17/h2-10,15H,11-13H2,1H3