3-tert-butyl-5-[1-[(4-phenyl-5-piperidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]ethyl]-1,2,4-oxadiazole

Systemtic Name: 3-tert-butyl-5-[1-[(4-phenyl-5-piperidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]ethyl]-1,2,4-oxadiazole Openeye Name: 3-tert-butyl-5-[1-[[4-phenyl-5-(1-piperidyl)-1,2,4-triazol-3-yl]sulfanyl]ethyl]-1,2,4-oxadiazole CAS Name: 3-tert-butyl-5-[1-[[4-phenyl-5-(1-piperidinyl)-1,2,4-triazol-3-yl]thio]ethyl]-1,2,4-oxadiazole IUPAC Name: 3-tert-butyl-5-[1-[(4-phenyl-5-piperidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]ethyl]-1,2,4-oxadiazole Traditional Name: 3-tert-butyl-5-[1-[(4-phenyl-5-piperidino-1,2,4-triazol-3-yl)thio]ethyl]-1,2,4-oxadiazole Formula: C21H28N6OS MolecularWeight: 412.55162

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=NO1)C(C)(C)C)SC2=NN=C(N2C3=CC=CC=C3)N4CCCCC4

Isomeric SMILES

CC(C1=NC(=NO1)C(C)(C)C)SC2=NN=C(N2C3=CC=CC=C3)N4CCCCC4

InChI

InChI=1S/C21H28N6OS/c1-15(17-22-18(25-28-17)21(2,3)4)29-20-24-23-19(26-13-9-6-10-14-26)27(20)16-11-7-5-8-12-16/h5,7-8,11-12,15H,6,9-10,13-14H2,1-4H3