3-chloranyl-N'-[3-(4-phenylpiperazin-1-ium-1-yl)propanoyl]-1-benzothiophene-2-carbohydrazide

Systemtic Name: 3-chloranyl-N'-[3-(4-phenylpiperazin-1-ium-1-yl)propanoyl]-1-benzothiophene-2-carbohydrazide Openeye Name: 3-chloro-N'-[3-(4-phenylpiperazin-1-ium-1-yl)propanoyl]benzothiophene-2-carbohydrazide CAS Name: 3-chloro-N'-[1-oxo-3-(4-phenyl-1-piperazin-1-iumyl)propyl]-1-benzothiophene-2-carbohydrazide IUPAC Name: 3-chloro-N'-[3-(4-phenylpiperazin-1-ium-1-yl)propanoyl]-1-benzothiophene-2-carbohydrazide Traditional Name: 3-chloro-N'-[3-(4-phenylpiperazin-1-ium-1-yl)propanoyl]benzothiophene-2-carbohydrazide Formula: C22H24ClN4O2S+ MolecularWeight: 443.96956

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCC(=O)NNC(=O)C2=C(C3=CC=CC=C3S2)Cl)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CCC(=O)NNC(=O)C2=C(C3=CC=CC=C3S2)Cl)C4=CC=CC=C4

InChI

InChI=1S/C22H23ClN4O2S/c23-20-17-8-4-5-9-18(17)30-21(20)22(29)25-24-19(28)10-11-26-12-14-27(15-13-26)16-6-2-1-3-7-16/h1-9H,10-15H2,(H,24,28)(H,25,29)/p+1