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

Systemtic Name: 3-(4-ethoxyphenyl)-5-[[4-(3-methylquinolin-8-yl)sulfonylpiperazin-1-yl]methyl]-1,2,4-oxadiazole Openeye Name: 3-(4-ethoxyphenyl)-5-[[4-[(3-methyl-8-quinolyl)sulfonyl]piperazin-1-yl]methyl]-1,2,4-oxadiazole CAS Name: 3-(4-ethoxyphenyl)-5-[[4-[(3-methyl-8-quinolinyl)sulfonyl]-1-piperazinyl]methyl]-1,2,4-oxadiazole IUPAC Name: 3-(4-ethoxyphenyl)-5-[[4-(3-methylquinolin-8-yl)sulfonylpiperazin-1-yl]methyl]-1,2,4-oxadiazole Traditional Name: 5-[[4-[(3-methyl-8-quinolyl)sulfonyl]piperazino]methyl]-3-p-phenetyl-1,2,4-oxadiazole Formula: C25H27N5O4S MolecularWeight: 493.57798

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NOC(=N2)CN3CCN(CC3)S(=O)(=O)C4=CC=CC5=CC(=CN=C54)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NOC(=N2)CN3CCN(CC3)S(=O)(=O)C4=CC=CC5=CC(=CN=C54)C

InChI

InChI=1S/C25H27N5O4S/c1-3-33-21-9-7-19(8-10-21)25-27-23(34-28-25)17-29-11-13-30(14-12-29)35(31,32)22-6-4-5-20-15-18(2)16-26-24(20)22/h4-10,15-16H,3,11-14,17H2,1-2H3