1-[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]-N-[(2S)-butan-2-yl]piperidine-4-carboxamide

Systemtic Name: 1-[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]-N-[(2S)-butan-2-yl]piperidine-4-carboxamide Openeye Name: 1-(1,1-dioxo-1,2-benzothiazol-3-yl)-N-[(1S)-1-methylpropyl]piperidine-4-carboxamide CAS Name: N-[(2S)-butan-2-yl]-1-(1,1-dioxo-1,2-benzothiazol-3-yl)-4-piperidinecarboxamide IUPAC Name: N-[(2S)-butan-2-yl]-1-(1,1-dioxo-1,2-benzothiazol-3-yl)piperidine-4-carboxamide Traditional Name: 1-(1,1-diketo-1,2-benzothiazol-3-yl)-N-[(1S)-1-methylpropyl]isonipecotamide Formula: C17H23N3O3S MolecularWeight: 349.44782

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1CCN(CC1)C2=NS(=O)(=O)C3=CC=CC=C32

Isomeric SMILES

CC[C@H](C)NC(=O)C1CCN(CC1)C2=NS(=O)(=O)C3=CC=CC=C32

InChI

InChI=1S/C17H23N3O3S/c1-3-12(2)18-17(21)13-8-10-20(11-9-13)16-14-6-4-5-7-15(14)24(22,23)19-16/h4-7,12-13H,3,8-11H2,1-2H3,(H,18,21)/t12-/m0/s1