5-tert-butyl-3-[[4-(3-methylquinolin-8-yl)sulfonylpiperazin-1-yl]methyl]-1,2,4-oxadiazole

Systemtic Name: 5-tert-butyl-3-[[4-(3-methylquinolin-8-yl)sulfonylpiperazin-1-yl]methyl]-1,2,4-oxadiazole Openeye Name: 5-tert-butyl-3-[[4-[(3-methyl-8-quinolyl)sulfonyl]piperazin-1-yl]methyl]-1,2,4-oxadiazole CAS Name: 5-tert-butyl-3-[[4-[(3-methyl-8-quinolinyl)sulfonyl]-1-piperazinyl]methyl]-1,2,4-oxadiazole IUPAC Name: 5-tert-butyl-3-[[4-(3-methylquinolin-8-yl)sulfonylpiperazin-1-yl]methyl]-1,2,4-oxadiazole Traditional Name: 5-tert-butyl-3-[[4-[(3-methyl-8-quinolyl)sulfonyl]piperazino]methyl]-1,2,4-oxadiazole Formula: C21H27N5O3S MolecularWeight: 429.53578

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C2C(=C1)C=CC=C2S(=O)(=O)N3CCN(CC3)CC4=NOC(=N4)C(C)(C)C

Isomeric SMILES

CC1=CN=C2C(=C1)C=CC=C2S(=O)(=O)N3CCN(CC3)CC4=NOC(=N4)C(C)(C)C

InChI

InChI=1S/C21H27N5O3S/c1-15-12-16-6-5-7-17(19(16)22-13-15)30(27,28)26-10-8-25(9-11-26)14-18-23-20(29-24-18)21(2,3)4/h5-7,12-13H,8-11,14H2,1-4H3