2-[(4-tert-butylphenyl)methylsulfanyl]-5-(quinolin-8-yloxymethyl)-1,3,4-oxadiazole

Systemtic Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-5-(quinolin-8-yloxymethyl)-1,3,4-oxadiazole Openeye Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-5-(8-quinolyloxymethyl)-1,3,4-oxadiazole CAS Name: 2-[(4-tert-butylphenyl)methylthio]-5-(8-quinolinyloxymethyl)-1,3,4-oxadiazole IUPAC Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-5-(quinolin-8-yloxymethyl)-1,3,4-oxadiazole Traditional Name: 2-[(4-tert-butylbenzyl)thio]-5-(8-quinolyloxymethyl)-1,3,4-oxadiazole Formula: C23H23N3O2S MolecularWeight: 405.51262

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CSC2=NN=C(O2)COC3=CC=CC4=C3N=CC=C4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CSC2=NN=C(O2)COC3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C23H23N3O2S/c1-23(2,3)18-11-9-16(10-12-18)15-29-22-26-25-20(28-22)14-27-19-8-4-6-17-7-5-13-24-21(17)19/h4-13H,14-15H2,1-3H3