N-[4-[[4-(4-piperazin-1-ylsulfonylphenyl)pyrimidin-2-yl]amino]phenyl]methanesulfonamide

Systemtic Name: N-[4-[[4-(4-piperazin-1-ylsulfonylphenyl)pyrimidin-2-yl]amino]phenyl]methanesulfonamide Openeye Name: N-[4-[[4-(4-piperazin-1-ylsulfonylphenyl)pyrimidin-2-yl]amino]phenyl]methanesulfonamide CAS Name: N-[4-[[4-[4-(1-piperazinylsulfonyl)phenyl]-2-pyrimidinyl]amino]phenyl]methanesulfonamide IUPAC Name: N-[4-[[4-(4-piperazin-1-ylsulfonylphenyl)pyrimidin-2-yl]amino]phenyl]methanesulfonamide Traditional Name: N-[4-[[4-(4-piperazinosulfonylphenyl)pyrimidin-2-yl]amino]phenyl]methanesulfonamide Formula: C21H24N6O4S2 MolecularWeight: 488.58306

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC=C(C=C1)NC2=NC=CC(=N2)C3=CC=C(C=C3)S(=O)(=O)N4CCNCC4

Isomeric SMILES

CS(=O)(=O)NC1=CC=C(C=C1)NC2=NC=CC(=N2)C3=CC=C(C=C3)S(=O)(=O)N4CCNCC4

InChI

InChI=1S/C21H24N6O4S2/c1-32(28,29)26-18-6-4-17(5-7-18)24-21-23-11-10-20(25-21)16-2-8-19(9-3-16)33(30,31)27-14-12-22-13-15-27/h2-11,22,26H,12-15H2,1H3,(H,23,24,25)