5-[(1S)-1-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-ium-1-yl]ethyl]-3-methyl-1,2,4-oxadiazole

Systemtic Name: 5-[(1S)-1-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-ium-1-yl]ethyl]-3-methyl-1,2,4-oxadiazole Openeye Name: 5-[(1S)-1-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-ium-1-yl]ethyl]-3-methyl-1,2,4-oxadiazole CAS Name: 5-[(1S)-1-[4-(4-tert-butylphenyl)sulfonyl-1-piperazin-1-iumyl]ethyl]-3-methyl-1,2,4-oxadiazole IUPAC Name: 5-[(1S)-1-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-ium-1-yl]ethyl]-3-methyl-1,2,4-oxadiazole Traditional Name: 5-[(1S)-1-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-ium-1-yl]ethyl]-3-methyl-1,2,4-oxadiazole Formula: C19H29N4O3S+ MolecularWeight: 393.52356

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=N1)C(C)[NH+]2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC1=NOC(=N1)[C@H](C)[NH+]2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C19H28N4O3S/c1-14(18-20-15(2)21-26-18)22-10-12-23(13-11-22)27(24,25)17-8-6-16(7-9-17)19(3,4)5/h6-9,14H,10-13H2,1-5H3/p+1/t14-/m0/s1