N-tert-butyl-3-[[5-methyl-2-[[3-(4-methylpiperazin-1-yl)sulfonylphenyl]amino]pyrimidin-4-yl]amino]benzenesulfonamide

Systemtic Name: N-tert-butyl-3-[[5-methyl-2-[[3-(4-methylpiperazin-1-yl)sulfonylphenyl]amino]pyrimidin-4-yl]amino]benzenesulfonamide Openeye Name: N-tert-butyl-3-[[5-methyl-2-[3-(4-methylpiperazin-1-yl)sulfonylanilino]pyrimidin-4-yl]amino]benzenesulfonamide CAS Name: N-tert-butyl-3-[[5-methyl-2-[3-[(4-methyl-1-piperazinyl)sulfonyl]anilino]-4-pyrimidinyl]amino]benzenesulfonamide IUPAC Name: N-tert-butyl-3-[[5-methyl-2-[3-(4-methylpiperazin-1-yl)sulfonylanilino]pyrimidin-4-yl]amino]benzenesulfonamide Traditional Name: N-tert-butyl-3-[[5-methyl-2-[3-(4-methylpiperazino)sulfonylanilino]pyrimidin-4-yl]amino]benzenesulfonamide Formula: C26H35N7O4S2 MolecularWeight: 573.7306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(N=C1NC2=CC(=CC=C2)S(=O)(=O)NC(C)(C)C)NC3=CC(=CC=C3)S(=O)(=O)N4CCN(CC4)C

Isomeric SMILES

CC1=CN=C(N=C1NC2=CC(=CC=C2)S(=O)(=O)NC(C)(C)C)NC3=CC(=CC=C3)S(=O)(=O)N4CCN(CC4)C

InChI

InChI=1S/C26H35N7O4S2/c1-19-18-27-25(29-21-9-7-11-23(17-21)39(36,37)33-14-12-32(5)13-15-33)30-24(19)28-20-8-6-10-22(16-20)38(34,35)31-26(2,3)4/h6-11,16-18,31H,12-15H2,1-5H3,(H2,27,28,29,30)