N'-[2-[4-(1,3-benzothiazol-2-yl)piperidin-1-ium-1-yl]ethanoyl]benzohydrazide

Systemtic Name: N'-[2-[4-(1,3-benzothiazol-2-yl)piperidin-1-ium-1-yl]ethanoyl]benzohydrazide Openeye Name: N'-[2-[4-(1,3-benzothiazol-2-yl)piperidin-1-ium-1-yl]acetyl]benzohydrazide CAS Name: N'-[2-[4-(1,3-benzothiazol-2-yl)-1-piperidin-1-iumyl]-1-oxoethyl]benzohydrazide IUPAC Name: N'-[2-[4-(1,3-benzothiazol-2-yl)piperidin-1-ium-1-yl]acetyl]benzohydrazide Traditional Name: N'-[2-[4-(1,3-benzothiazol-2-yl)piperidin-1-ium-1-yl]acetyl]benzohydrazide Formula: C21H23N4O2S+ MolecularWeight: 395.49792

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C2=NC3=CC=CC=C3S2)CC(=O)NNC(=O)C4=CC=CC=C4

Isomeric SMILES

C1C[NH+](CCC1C2=NC3=CC=CC=C3S2)CC(=O)NNC(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H22N4O2S/c26-19(23-24-20(27)15-6-2-1-3-7-15)14-25-12-10-16(11-13-25)21-22-17-8-4-5-9-18(17)28-21/h1-9,16H,10-14H2,(H,23,26)(H,24,27)/p+1