3-(4-bromophenyl)-5-[1-(2,4,6-trimethylphenyl)sulfonylpiperidin-4-yl]-1,2,4-oxadiazole

Systemtic Name: 3-(4-bromophenyl)-5-[1-(2,4,6-trimethylphenyl)sulfonylpiperidin-4-yl]-1,2,4-oxadiazole Openeye Name: 3-(4-bromophenyl)-5-[1-(2,4,6-trimethylphenyl)sulfonyl-4-piperidyl]-1,2,4-oxadiazole CAS Name: 3-(4-bromophenyl)-5-[1-(2,4,6-trimethylphenyl)sulfonyl-4-piperidinyl]-1,2,4-oxadiazole IUPAC Name: 3-(4-bromophenyl)-5-[1-(2,4,6-trimethylphenyl)sulfonylpiperidin-4-yl]-1,2,4-oxadiazole Traditional Name: 3-(4-bromophenyl)-5-(1-mesitylsulfonyl-4-piperidyl)-1,2,4-oxadiazole Formula: C22H24BrN3O3S MolecularWeight: 490.41326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCC(CC2)C3=NC(=NO3)C4=CC=C(C=C4)Br)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCC(CC2)C3=NC(=NO3)C4=CC=C(C=C4)Br)C

InChI

InChI=1S/C22H24BrN3O3S/c1-14-12-15(2)20(16(3)13-14)30(27,28)26-10-8-18(9-11-26)22-24-21(25-29-22)17-4-6-19(23)7-5-17/h4-7,12-13,18H,8-11H2,1-3H3