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

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

CCCCC1=NOC(=N1)CN2CCN(CC2)S(=O)(=O)C3=CC=CC4=CC(=CN=C43)C

Isomeric SMILES

CCCCC1=NOC(=N1)CN2CCN(CC2)S(=O)(=O)C3=CC=CC4=CC(=CN=C43)C

InChI

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