(4-pyridin-1-ium-2-ylpiperazin-1-yl)-(1,2,5-thiadiazol-3-yl)methanone

Systemtic Name: (4-pyridin-1-ium-2-ylpiperazin-1-yl)-(1,2,5-thiadiazol-3-yl)methanone Openeye Name: (4-pyridin-1-ium-2-ylpiperazin-1-yl)-(1,2,5-thiadiazol-3-yl)methanone CAS Name: [4-(2-pyridin-1-iumyl)-1-piperazinyl]-(1,2,5-thiadiazol-3-yl)methanone IUPAC Name: (4-pyridin-1-ium-2-ylpiperazin-1-yl)-(1,2,5-thiadiazol-3-yl)methanone Traditional Name: (4-pyridin-1-ium-2-ylpiperazino)-(1,2,5-thiadiazol-3-yl)methanone Formula: C12H14N5OS+ MolecularWeight: 276.33746

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=[NH+]2)C(=O)C3=NSN=C3

Isomeric SMILES

C1CN(CCN1C2=CC=CC=[NH+]2)C(=O)C3=NSN=C3

InChI

InChI=1S/C12H13N5OS/c18-12(10-9-14-19-15-10)17-7-5-16(6-8-17)11-3-1-2-4-13-11/h1-4,9H,5-8H2/p+1