3-(2-ethoxyphenyl)-5-[(4-phenylphthalazin-1-yl)sulfanylmethyl]-1,2,4-oxadiazole

Systemtic Name: 3-(2-ethoxyphenyl)-5-[(4-phenylphthalazin-1-yl)sulfanylmethyl]-1,2,4-oxadiazole Openeye Name: 3-(2-ethoxyphenyl)-5-[(4-phenylphthalazin-1-yl)sulfanylmethyl]-1,2,4-oxadiazole CAS Name: 3-(2-ethoxyphenyl)-5-[[(4-phenyl-1-phthalazinyl)thio]methyl]-1,2,4-oxadiazole IUPAC Name: 3-(2-ethoxyphenyl)-5-[(4-phenylphthalazin-1-yl)sulfanylmethyl]-1,2,4-oxadiazole Traditional Name: 3-o-phenetyl-5-[[(4-phenylphthalazin-1-yl)thio]methyl]-1,2,4-oxadiazole Formula: C25H20N4O2S MolecularWeight: 440.5169

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C2=NOC(=N2)CSC3=NN=C(C4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

CCOC1=CC=CC=C1C2=NOC(=N2)CSC3=NN=C(C4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C25H20N4O2S/c1-2-30-21-15-9-8-14-20(21)24-26-22(31-29-24)16-32-25-19-13-7-6-12-18(19)23(27-28-25)17-10-4-3-5-11-17/h3-15H,2,16H2,1H3