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

Systemtic Name: N-methyl-3-[[5-methyl-2-[[4-(4-methylpiperazin-1-yl)phenyl]amino]pyrimidin-4-yl]amino]benzenesulfonamide Openeye Name: N-methyl-3-[[5-methyl-2-[4-(4-methylpiperazin-1-yl)anilino]pyrimidin-4-yl]amino]benzenesulfonamide CAS Name: N-methyl-3-[[5-methyl-2-[4-(4-methyl-1-piperazinyl)anilino]-4-pyrimidinyl]amino]benzenesulfonamide IUPAC Name: N-methyl-3-[[5-methyl-2-[4-(4-methylpiperazin-1-yl)anilino]pyrimidin-4-yl]amino]benzenesulfonamide Traditional Name: N-methyl-3-[[5-methyl-2-[4-(4-methylpiperazino)anilino]pyrimidin-4-yl]amino]benzenesulfonamide Formula: C23H29N7O2S MolecularWeight: 467.58706

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H29N7O2S/c1-17-16-25-23(27-18-7-9-20(10-8-18)30-13-11-29(3)12-14-30)28-22(17)26-19-5-4-6-21(15-19)33(31,32)24-2/h4-10,15-16,24H,11-14H2,1-3H3,(H2,25,26,27,28)