1-[4-(1,2-benzothiazol-3-ylcarbonyl)piperazin-1-yl]pentan-1-one

Systemtic Name: 1-[4-(1,2-benzothiazol-3-ylcarbonyl)piperazin-1-yl]pentan-1-one Openeye Name: 1-[4-(1,2-benzothiazole-3-carbonyl)piperazin-1-yl]pentan-1-one CAS Name: 1-[4-[1,2-benzothiazol-3-yl(oxo)methyl]-1-piperazinyl]-1-pentanone IUPAC Name: 1-[4-(1,2-benzothiazole-3-carbonyl)piperazin-1-yl]pentan-1-one Traditional Name: 1-[4-(1,2-benzothiazole-3-carbonyl)piperazino]pentan-1-one Formula: C17H21N3O2S MolecularWeight: 331.43254

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)N1CCN(CC1)C(=O)C2=NSC3=CC=CC=C32

Isomeric SMILES

CCCCC(=O)N1CCN(CC1)C(=O)C2=NSC3=CC=CC=C32

InChI

InChI=1S/C17H21N3O2S/c1-2-3-8-15(21)19-9-11-20(12-10-19)17(22)16-13-6-4-5-7-14(13)23-18-16/h4-7H,2-3,8-12H2,1H3