2-methyl-5-piperazin-4-ium-1-ylsulfanyl-1,3,4-thiadiazole

Systemtic Name: 2-methyl-5-piperazin-4-ium-1-ylsulfanyl-1,3,4-thiadiazole Openeye Name: 2-methyl-5-piperazin-4-ium-1-ylsulfanyl-1,3,4-thiadiazole CAS Name: 2-methyl-5-(1-piperazin-4-iumylthio)-1,3,4-thiadiazole IUPAC Name: 2-methyl-5-piperazin-4-ium-1-ylsulfanyl-1,3,4-thiadiazole Traditional Name: 2-methyl-5-(piperazin-4-ium-1-ylthio)-1,3,4-thiadiazole Formula: C7H13N4S2+ MolecularWeight: 217.33492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(S1)SN2CC[NH2+]CC2

Isomeric SMILES

CC1=NN=C(S1)SN2CC[NH2+]CC2

InChI

InChI=1S/C7H12N4S2/c1-6-9-10-7(12-6)13-11-4-2-8-3-5-11/h8H,2-5H2,1H3/p+1