4-[5-(4-pyridin-1-ium-2-ylpiperazin-1-yl)sulfonylthiophen-2-yl]-1,2,3-thiadiazole

Systemtic Name: 4-[5-(4-pyridin-1-ium-2-ylpiperazin-1-yl)sulfonylthiophen-2-yl]-1,2,3-thiadiazole Openeye Name: 4-[5-(4-pyridin-1-ium-2-ylpiperazin-1-yl)sulfonyl-2-thienyl]thiadiazole CAS Name: 4-[5-[[4-(2-pyridin-1-iumyl)-1-piperazinyl]sulfonyl]-2-thiophenyl]thiadiazole IUPAC Name: 4-[5-(4-pyridin-1-ium-2-ylpiperazin-1-yl)sulfonylthiophen-2-yl]thiadiazole Traditional Name: 4-[5-(4-pyridin-1-ium-2-ylpiperazino)sulfonyl-2-thienyl]thiadiazole Formula: C15H16N5O2S3+ MolecularWeight: 394.51484

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=[NH+]2)S(=O)(=O)C3=CC=C(S3)C4=CSN=N4

Isomeric SMILES

C1CN(CCN1C2=CC=CC=[NH+]2)S(=O)(=O)C3=CC=C(S3)C4=CSN=N4

InChI

InChI=1S/C15H15N5O2S3/c21-25(22,15-5-4-13(24-15)12-11-23-18-17-12)20-9-7-19(8-10-20)14-3-1-2-6-16-14/h1-6,11H,7-10H2/p+1