1-[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]-N-(2-phenylpyrimidin-5-yl)piperidine-4-carboxamide

Systemtic Name: 1-[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]-N-(2-phenylpyrimidin-5-yl)piperidine-4-carboxamide Openeye Name: 1-(1,1-dioxo-1,2-benzothiazol-3-yl)-N-(2-phenylpyrimidin-5-yl)piperidine-4-carboxamide CAS Name: 1-(1,1-dioxo-1,2-benzothiazol-3-yl)-N-(2-phenyl-5-pyrimidinyl)-4-piperidinecarboxamide IUPAC Name: 1-(1,1-dioxo-1,2-benzothiazol-3-yl)-N-(2-phenylpyrimidin-5-yl)piperidine-4-carboxamide Traditional Name: 1-(1,1-diketo-1,2-benzothiazol-3-yl)-N-(2-phenylpyrimidin-5-yl)isonipecotamide Formula: C23H21N5O3S MolecularWeight: 447.50954

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CN=C(N=C2)C3=CC=CC=C3)C4=NS(=O)(=O)C5=CC=CC=C54

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CN=C(N=C2)C3=CC=CC=C3)C4=NS(=O)(=O)C5=CC=CC=C54

InChI

InChI=1S/C23H21N5O3S/c29-23(26-18-14-24-21(25-15-18)16-6-2-1-3-7-16)17-10-12-28(13-11-17)22-19-8-4-5-9-20(19)32(30,31)27-22/h1-9,14-15,17H,10-13H2,(H,26,29)