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

Systemtic Name: 3-(2-methylpropyl)-5-[[4-(3-methylquinolin-8-yl)sulfonylpiperazin-1-yl]methyl]-1,2,4-oxadiazole Openeye Name: 3-isobutyl-5-[[4-[(3-methyl-8-quinolyl)sulfonyl]piperazin-1-yl]methyl]-1,2,4-oxadiazole CAS Name: 3-(2-methylpropyl)-5-[[4-[(3-methyl-8-quinolinyl)sulfonyl]-1-piperazinyl]methyl]-1,2,4-oxadiazole IUPAC Name: 3-(2-methylpropyl)-5-[[4-(3-methylquinolin-8-yl)sulfonylpiperazin-1-yl]methyl]-1,2,4-oxadiazole Traditional Name: 3-isobutyl-5-[[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=NC(=NO4)CC(C)C

Isomeric SMILES

CC1=CN=C2C(=C1)C=CC=C2S(=O)(=O)N3CCN(CC3)CC4=NC(=NO4)CC(C)C

InChI

InChI=1S/C21H27N5O3S/c1-15(2)11-19-23-20(29-24-19)14-25-7-9-26(10-8-25)30(27,28)18-6-4-5-17-12-16(3)13-22-21(17)18/h4-6,12-13,15H,7-11,14H2,1-3H3