4-methyl-N'-[3-(4-phenylpiperazin-1-ium-1-yl)propanoyl]-1,2,3-thiadiazole-5-carbohydrazide

Systemtic Name: 4-methyl-N'-[3-(4-phenylpiperazin-1-ium-1-yl)propanoyl]-1,2,3-thiadiazole-5-carbohydrazide Openeye Name: 4-methyl-N'-[3-(4-phenylpiperazin-1-ium-1-yl)propanoyl]thiadiazole-5-carbohydrazide CAS Name: 4-methyl-N'-[1-oxo-3-(4-phenyl-1-piperazin-1-iumyl)propyl]-5-thiadiazolecarbohydrazide IUPAC Name: 4-methyl-N'-[3-(4-phenylpiperazin-1-ium-1-yl)propanoyl]thiadiazole-5-carbohydrazide Traditional Name: 4-methyl-N'-[3-(4-phenylpiperazin-1-ium-1-yl)propanoyl]thiadiazole-5-carbohydrazide Formula: C17H23N6O2S+ MolecularWeight: 375.46852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SN=N1)C(=O)NNC(=O)CC[NH+]2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

CC1=C(SN=N1)C(=O)NNC(=O)CC[NH+]2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C17H22N6O2S/c1-13-16(26-21-18-13)17(25)20-19-15(24)7-8-22-9-11-23(12-10-22)14-5-3-2-4-6-14/h2-6H,7-12H2,1H3,(H,19,24)(H,20,25)/p+1