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

Systemtic Name: (3S)-1-[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]-N-butyl-N-phenyl-piperidine-3-carboxamide Openeye Name: (3S)-N-butyl-1-(1,1-dioxo-1,2-benzothiazol-3-yl)-N-phenyl-piperidine-3-carboxamide CAS Name: (3S)-N-butyl-1-(1,1-dioxo-1,2-benzothiazol-3-yl)-N-phenyl-3-piperidinecarboxamide IUPAC Name: (3S)-N-butyl-1-(1,1-dioxo-1,2-benzothiazol-3-yl)-N-phenylpiperidine-3-carboxamide Traditional Name: (3S)-N-butyl-1-(1,1-diketo-1,2-benzothiazol-3-yl)-N-phenyl-nipecotamide Formula: C23H27N3O3S MolecularWeight: 425.54378

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=CC=CC=C1)C(=O)C2CCCN(C2)C3=NS(=O)(=O)C4=CC=CC=C43

Isomeric SMILES

CCCCN(C1=CC=CC=C1)C(=O)[C@H]2CCCN(C2)C3=NS(=O)(=O)C4=CC=CC=C43

InChI

InChI=1S/C23H27N3O3S/c1-2-3-16-26(19-11-5-4-6-12-19)23(27)18-10-9-15-25(17-18)22-20-13-7-8-14-21(20)30(28,29)24-22/h4-8,11-14,18H,2-3,9-10,15-17H2,1H3/t18-/m0/s1