4-methyl-N-[1,1,3-tris(oxidanylidene)-2-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]-1,2-benzothiazol-6-yl]benzenesulfonamide

Systemtic Name: 4-methyl-N-[1,1,3-tris(oxidanylidene)-2-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]-1,2-benzothiazol-6-yl]benzenesulfonamide Openeye Name: 4-methyl-N-[1,1,3-trioxo-2-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]-1,2-benzothiazol-6-yl]benzenesulfonamide CAS Name: 4-methyl-N-[1,1,3-trioxo-2-[4-[4-(2-pyrimidinyl)-1-piperazinyl]butyl]-1,2-benzothiazol-6-yl]benzenesulfonamide IUPAC Name: 4-methyl-N-[1,1,3-trioxo-2-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]-1,2-benzothiazol-6-yl]benzenesulfonamide Traditional Name: 4-methyl-N-[1,1,3-triketo-2-[4-[4-(2-pyrimidyl)piperazino]butyl]-1,2-benzothiazol-6-yl]benzenesulfonamide Formula: C26H30N6O5S2 MolecularWeight: 570.6836

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC3=C(C=C2)C(=O)N(S3(=O)=O)CCCCN4CCN(CC4)C5=NC=CC=N5

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC3=C(C=C2)C(=O)N(S3(=O)=O)CCCCN4CCN(CC4)C5=NC=CC=N5

InChI

InChI=1S/C26H30N6O5S2/c1-20-5-8-22(9-6-20)38(34,35)29-21-7-10-23-24(19-21)39(36,37)32(25(23)33)14-3-2-13-30-15-17-31(18-16-30)26-27-11-4-12-28-26/h4-12,19,29H,2-3,13-18H2,1H3