5-methyl-3-[4-[[4-(4-propylphenyl)sulfonylpiperazin-1-yl]methyl]phenyl]-1,2,4-oxadiazole

Systemtic Name: 5-methyl-3-[4-[[4-(4-propylphenyl)sulfonylpiperazin-1-yl]methyl]phenyl]-1,2,4-oxadiazole Openeye Name: 5-methyl-3-[4-[[4-(4-propylphenyl)sulfonylpiperazin-1-yl]methyl]phenyl]-1,2,4-oxadiazole CAS Name: 5-methyl-3-[4-[[4-(4-propylphenyl)sulfonyl-1-piperazinyl]methyl]phenyl]-1,2,4-oxadiazole IUPAC Name: 5-methyl-3-[4-[[4-(4-propylphenyl)sulfonylpiperazin-1-yl]methyl]phenyl]-1,2,4-oxadiazole Traditional Name: 5-methyl-3-[4-[[4-(4-propylphenyl)sulfonylpiperazino]methyl]phenyl]-1,2,4-oxadiazole Formula: C23H28N4O3S MolecularWeight: 440.55842

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CC=C(C=C3)C4=NOC(=N4)C

Isomeric SMILES

CCCC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CC=C(C=C3)C4=NOC(=N4)C

InChI

InChI=1S/C23H28N4O3S/c1-3-4-19-7-11-22(12-8-19)31(28,29)27-15-13-26(14-16-27)17-20-5-9-21(10-6-20)23-24-18(2)30-25-23/h5-12H,3-4,13-17H2,1-2H3