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

Systemtic Name: 3-butyl-5-[[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]methyl]-1,2,4-oxadiazole Openeye Name: 3-butyl-5-[[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]methyl]-1,2,4-oxadiazole CAS Name: 3-butyl-5-[[4-(3,4-dimethylphenyl)sulfonyl-1-piperazinyl]methyl]-1,2,4-oxadiazole IUPAC Name: 3-butyl-5-[[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]methyl]-1,2,4-oxadiazole Traditional Name: 3-butyl-5-[[4-(3,4-dimethylphenyl)sulfonylpiperazino]methyl]-1,2,4-oxadiazole Formula: C19H28N4O3S MolecularWeight: 392.51562

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H28N4O3S/c1-4-5-6-18-20-19(26-21-18)14-22-9-11-23(12-10-22)27(24,25)17-8-7-15(2)16(3)13-17/h7-8,13H,4-6,9-12,14H2,1-3H3