5-[[4-(5-methylthiophen-2-yl)sulfonylpiperazin-1-ium-1-yl]methyl]-3-propyl-1,2,4-oxadiazole

Systemtic Name: 5-[[4-(5-methylthiophen-2-yl)sulfonylpiperazin-1-ium-1-yl]methyl]-3-propyl-1,2,4-oxadiazole Openeye Name: 5-[[4-[(5-methyl-2-thienyl)sulfonyl]piperazin-1-ium-1-yl]methyl]-3-propyl-1,2,4-oxadiazole CAS Name: 5-[[4-[(5-methyl-2-thiophenyl)sulfonyl]-1-piperazin-1-iumyl]methyl]-3-propyl-1,2,4-oxadiazole IUPAC Name: 5-[[4-(5-methylthiophen-2-yl)sulfonylpiperazin-1-ium-1-yl]methyl]-3-propyl-1,2,4-oxadiazole Traditional Name: 5-[[4-[(5-methyl-2-thienyl)sulfonyl]piperazin-1-ium-1-yl]methyl]-3-propyl-1,2,4-oxadiazole Formula: C15H23N4O3S2+ MolecularWeight: 371.49812

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NOC(=N1)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=C(S3)C

Isomeric SMILES

CCCC1=NOC(=N1)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=C(S3)C

InChI

InChI=1S/C15H22N4O3S2/c1-3-4-13-16-14(22-17-13)11-18-7-9-19(10-8-18)24(20,21)15-6-5-12(2)23-15/h5-6H,3-4,7-11H2,1-2H3/p+1