N-(1,3-benzothiazol-2-yl)-2-[4-[6-(2-ethanoylhydrazinyl)-6-oxidanylidene-hexyl]piperazin-1-yl]ethanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-2-[4-[6-(2-ethanoylhydrazinyl)-6-oxidanylidene-hexyl]piperazin-1-yl]ethanamide Openeye Name: 2-[4-[6-(2-acetylhydrazino)-6-oxo-hexyl]piperazin-1-yl]-N-(1,3-benzothiazol-2-yl)acetamide CAS Name: 2-[4-[6-(acetylhydrazo)-6-oxohexyl]-1-piperazinyl]-N-(1,3-benzothiazol-2-yl)acetamide IUPAC Name: 2-[4-[6-(2-acetylhydrazinyl)-6-oxohexyl]piperazin-1-yl]-N-(1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-[4-[6-(N'-acetylhydrazino)-6-keto-hexyl]piperazino]-N-(1,3-benzothiazol-2-yl)acetamide Formula: C21H30N6O3S MolecularWeight: 446.5663

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NNC(=O)CCCCCN1CCN(CC1)CC(=O)NC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC(=O)NNC(=O)CCCCCN1CCN(CC1)CC(=O)NC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C21H30N6O3S/c1-16(28)24-25-19(29)9-3-2-6-10-26-11-13-27(14-12-26)15-20(30)23-21-22-17-7-4-5-8-18(17)31-21/h4-5,7-8H,2-3,6,9-15H2,1H3,(H,24,28)(H,25,29)(H,22,23,30)