2-methyl-5-[(4-naphthalen-2-ylsulfonylpiperazin-1-ium-1-yl)methyl]-1,3,4-oxadiazole

Systemtic Name: 2-methyl-5-[(4-naphthalen-2-ylsulfonylpiperazin-1-ium-1-yl)methyl]-1,3,4-oxadiazole Openeye Name: 2-methyl-5-[[4-(2-naphthylsulfonyl)piperazin-1-ium-1-yl]methyl]-1,3,4-oxadiazole CAS Name: 2-methyl-5-[[4-(2-naphthalenylsulfonyl)-1-piperazin-1-iumyl]methyl]-1,3,4-oxadiazole IUPAC Name: 2-methyl-5-[(4-naphthalen-2-ylsulfonylpiperazin-1-ium-1-yl)methyl]-1,3,4-oxadiazole Traditional Name: 2-methyl-5-[[4-(2-naphthylsulfonyl)piperazin-1-ium-1-yl]methyl]-1,3,4-oxadiazole Formula: C18H21N4O3S+ MolecularWeight: 373.44934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(O1)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CC1=NN=C(O1)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C18H20N4O3S/c1-14-19-20-18(25-14)13-21-8-10-22(11-9-21)26(23,24)17-7-6-15-4-2-3-5-16(15)12-17/h2-7,12H,8-11,13H2,1H3/p+1