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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21N3O2S/c1-12(2)11-15(21)19-7-9-20(10-8-19)17(22)16-13-5-3-4-6-14(13)23-18-16/h3-6,12H,7-11H2,1-2H3