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

Systemtic Name: 1-[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]-N-(2-phenylphenyl)piperidine-3-carboxamide Openeye Name: 1-(1,1-dioxo-1,2-benzothiazol-3-yl)-N-(2-phenylphenyl)piperidine-3-carboxamide CAS Name: 1-(1,1-dioxo-1,2-benzothiazol-3-yl)-N-(2-phenylphenyl)-3-piperidinecarboxamide IUPAC Name: 1-(1,1-dioxo-1,2-benzothiazol-3-yl)-N-(2-phenylphenyl)piperidine-3-carboxamide Traditional Name: 1-(1,1-diketo-1,2-benzothiazol-3-yl)-N-(2-phenylphenyl)nipecotamide Formula: C25H23N3O3S MolecularWeight: 445.53342

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=NS(=O)(=O)C3=CC=CC=C32)C(=O)NC4=CC=CC=C4C5=CC=CC=C5

Isomeric SMILES

C1CC(CN(C1)C2=NS(=O)(=O)C3=CC=CC=C32)C(=O)NC4=CC=CC=C4C5=CC=CC=C5

InChI

InChI=1S/C25H23N3O3S/c29-25(26-22-14-6-4-12-20(22)18-9-2-1-3-10-18)19-11-8-16-28(17-19)24-21-13-5-7-15-23(21)32(30,31)27-24/h1-7,9-10,12-15,19H,8,11,16-17H2,(H,26,29)