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

Systemtic Name: 5-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-3-(4-ethoxyphenyl)-1,2,4-oxadiazole Openeye Name: 5-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-3-(4-ethoxyphenyl)-1,2,4-oxadiazole CAS Name: 5-[[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)thio]methyl]-3-(4-ethoxyphenyl)-1,2,4-oxadiazole IUPAC Name: 5-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-3-(4-ethoxyphenyl)-1,2,4-oxadiazole Traditional Name: 5-[[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)thio]methyl]-3-p-phenetyl-1,2,4-oxadiazole Formula: C22H21N5O2S MolecularWeight: 419.49944

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NOC(=N2)CSC3=NN=C(N3C4=CC=CC=C4)C5CC5

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NOC(=N2)CSC3=NN=C(N3C4=CC=CC=C4)C5CC5

InChI

InChI=1S/C22H21N5O2S/c1-2-28-18-12-10-15(11-13-18)20-23-19(29-26-20)14-30-22-25-24-21(16-8-9-16)27(22)17-6-4-3-5-7-17/h3-7,10-13,16H,2,8-9,14H2,1H3