3-tert-butyl-5-[1-[5-(4-methylpiperazin-1-yl)sulfonylpyridin-2-yl]sulfanylethyl]-1,2,4-oxadiazole

Systemtic Name: 3-tert-butyl-5-[1-[5-(4-methylpiperazin-1-yl)sulfonylpyridin-2-yl]sulfanylethyl]-1,2,4-oxadiazole Openeye Name: 3-tert-butyl-5-[1-[[5-(4-methylpiperazin-1-yl)sulfonyl-2-pyridyl]sulfanyl]ethyl]-1,2,4-oxadiazole CAS Name: 3-tert-butyl-5-[1-[[5-[(4-methyl-1-piperazinyl)sulfonyl]-2-pyridinyl]thio]ethyl]-1,2,4-oxadiazole IUPAC Name: 3-tert-butyl-5-[1-[5-(4-methylpiperazin-1-yl)sulfonylpyridin-2-yl]sulfanylethyl]-1,2,4-oxadiazole Traditional Name: 3-tert-butyl-5-[1-[[5-(4-methylpiperazino)sulfonyl-2-pyridyl]thio]ethyl]-1,2,4-oxadiazole Formula: C18H27N5O3S2 MolecularWeight: 425.56868

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=NO1)C(C)(C)C)SC2=NC=C(C=C2)S(=O)(=O)N3CCN(CC3)C

Isomeric SMILES

CC(C1=NC(=NO1)C(C)(C)C)SC2=NC=C(C=C2)S(=O)(=O)N3CCN(CC3)C

InChI

InChI=1S/C18H27N5O3S2/c1-13(16-20-17(21-26-16)18(2,3)4)27-15-7-6-14(12-19-15)28(24,25)23-10-8-22(5)9-11-23/h6-7,12-13H,8-11H2,1-5H3