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

Systemtic Name: 5-[(4-cyclopropyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-3-(4-ethoxyphenyl)-1,2,4-oxadiazole Openeye Name: 5-[[4-cyclopropyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-3-(4-ethoxyphenyl)-1,2,4-oxadiazole CAS Name: 5-[[(4-cyclopropyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]methyl]-3-(4-ethoxyphenyl)-1,2,4-oxadiazole IUPAC Name: 5-[(4-cyclopropyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-3-(4-ethoxyphenyl)-1,2,4-oxadiazole Traditional Name: 5-[[[4-cyclopropyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]methyl]-3-p-phenetyl-1,2,4-oxadiazole Formula: C21H20N6O2S MolecularWeight: 420.4875

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NOC(=N2)CSC3=NN=C(N3C4CC4)C5=CC=NC=C5

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NOC(=N2)CSC3=NN=C(N3C4CC4)C5=CC=NC=C5

InChI

InChI=1S/C21H20N6O2S/c1-2-28-17-7-3-14(4-8-17)19-23-18(29-26-19)13-30-21-25-24-20(27(21)16-5-6-16)15-9-11-22-12-10-15/h3-4,7-12,16H,2,5-6,13H2,1H3