N-(1,3-benzothiazol-2-yl)-N-[2-oxidanylidene-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]benzenesulfonamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-N-[2-oxidanylidene-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]benzenesulfonamide Openeye Name: N-(1,3-benzothiazol-2-yl)-N-[2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]benzenesulfonamide CAS Name: N-(1,3-benzothiazol-2-yl)-N-[2-oxo-2-[4-(2-pyrimidinyl)-1-piperazinyl]ethyl]benzenesulfonamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-N-[2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]benzenesulfonamide Traditional Name: N-(1,3-benzothiazol-2-yl)-N-[2-keto-2-[4-(2-pyrimidyl)piperazino]ethyl]benzenesulfonamide Formula: C23H22N6O3S2 MolecularWeight: 494.58918

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)CN(C3=NC4=CC=CC=C4S3)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)CN(C3=NC4=CC=CC=C4S3)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C23H22N6O3S2/c30-21(27-13-15-28(16-14-27)22-24-11-6-12-25-22)17-29(34(31,32)18-7-2-1-3-8-18)23-26-19-9-4-5-10-20(19)33-23/h1-12H,13-17H2