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

Systemtic Name: 5-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-3-(4-methoxyphenyl)-1,2,4-oxadiazole Openeye Name: 5-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-3-(4-methoxyphenyl)-1,2,4-oxadiazole CAS Name: 5-[[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)thio]methyl]-3-(4-methoxyphenyl)-1,2,4-oxadiazole IUPAC Name: 5-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-3-(4-methoxyphenyl)-1,2,4-oxadiazole Traditional Name: 5-[[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)thio]methyl]-3-(4-methoxyphenyl)-1,2,4-oxadiazole Formula: C21H19N5O2S MolecularWeight: 405.47286

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NOC(=N2)CSC3=NN=C(N3C4=CC=CC=C4)C5CC5

Isomeric SMILES

COC1=CC=C(C=C1)C2=NOC(=N2)CSC3=NN=C(N3C4=CC=CC=C4)C5CC5

InChI

InChI=1S/C21H19N5O2S/c1-27-17-11-9-14(10-12-17)19-22-18(28-25-19)13-29-21-24-23-20(15-7-8-15)26(21)16-5-3-2-4-6-16/h2-6,9-12,15H,7-8,13H2,1H3