2,4,6-tris(oxidanylidene)-3-(4-phenoxyphenyl)-1-piperazin-1-yl-5-pyrimidin-5-yl-cyclohexane-1-sulfonamide

Systemtic Name: 2,4,6-tris(oxidanylidene)-3-(4-phenoxyphenyl)-1-piperazin-1-yl-5-pyrimidin-5-yl-cyclohexane-1-sulfonamide Openeye Name: 2,4,6-trioxo-3-(4-phenoxyphenyl)-1-piperazin-1-yl-5-pyrimidin-5-yl-cyclohexanesulfonamide CAS Name: 2,4,6-trioxo-3-(4-phenoxyphenyl)-1-(1-piperazinyl)-5-(5-pyrimidinyl)-1-cyclohexanesulfonamide IUPAC Name: 2,4,6-trioxo-3-(4-phenoxyphenyl)-1-piperazin-1-yl-5-pyrimidin-5-ylcyclohexane-1-sulfonamide Traditional Name: 2,4,6-triketo-3-(4-phenoxyphenyl)-1-piperazino-5-(5-pyrimidyl)cyclohexanesulfonamide Formula: C26H25N5O6S MolecularWeight: 535.5716

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2(C(=O)C(C(=O)C(C2=O)C3=CN=CN=C3)C4=CC=C(C=C4)OC5=CC=CC=C5)S(=O)(=O)N

Isomeric SMILES

C1CN(CCN1)C2(C(=O)C(C(=O)C(C2=O)C3=CN=CN=C3)C4=CC=C(C=C4)OC5=CC=CC=C5)S(=O)(=O)N

InChI

InChI=1S/C26H25N5O6S/c27-38(35,36)26(31-12-10-28-11-13-31)24(33)21(23(32)22(25(26)34)18-14-29-16-30-15-18)17-6-8-20(9-7-17)37-19-4-2-1-3-5-19/h1-9,14-16,21-22,28H,10-13H2,(H2,27,35,36)