5-chloranyl-4-[(4-phenylpiperazin-1-ium-1-yl)methyl]-1,2,3-thiadiazole

Systemtic Name: 5-chloranyl-4-[(4-phenylpiperazin-1-ium-1-yl)methyl]-1,2,3-thiadiazole Openeye Name: 5-chloro-4-[(4-phenylpiperazin-1-ium-1-yl)methyl]thiadiazole CAS Name: 5-chloro-4-[(4-phenyl-1-piperazin-1-iumyl)methyl]thiadiazole IUPAC Name: 5-chloro-4-[(4-phenylpiperazin-1-ium-1-yl)methyl]thiadiazole Traditional Name: 5-chloro-4-[(4-phenylpiperazin-1-ium-1-yl)methyl]thiadiazole Formula: C13H16ClN4S+ MolecularWeight: 295.81094

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=C(SN=N2)Cl)C3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH+]1CC2=C(SN=N2)Cl)C3=CC=CC=C3

InChI

InChI=1S/C13H15ClN4S/c14-13-12(15-16-19-13)10-17-6-8-18(9-7-17)11-4-2-1-3-5-11/h1-5H,6-10H2/p+1