2-[[5-chloranyl-2-[[2-ethoxy-4-(1-methylpiperidin-4-yl)oxy-phenyl]amino]pyrimidin-4-yl]amino]-N-cyclopentyl-benzenesulfonamide

Systemtic Name: 2-[[5-chloranyl-2-[[2-ethoxy-4-(1-methylpiperidin-4-yl)oxy-phenyl]amino]pyrimidin-4-yl]amino]-N-cyclopentyl-benzenesulfonamide Openeye Name: 2-[[5-chloro-2-[2-ethoxy-4-[(1-methyl-4-piperidyl)oxy]anilino]pyrimidin-4-yl]amino]-N-cyclopentyl-benzenesulfonamide CAS Name: 2-[[5-chloro-2-[2-ethoxy-4-[(1-methyl-4-piperidinyl)oxy]anilino]-4-pyrimidinyl]amino]-N-cyclopentylbenzenesulfonamide IUPAC Name: 2-[[5-chloro-2-[2-ethoxy-4-(1-methylpiperidin-4-yl)oxyanilino]pyrimidin-4-yl]amino]-N-cyclopentylbenzenesulfonamide Traditional Name: 2-[[5-chloro-2-[2-ethoxy-4-[(1-methyl-4-piperidyl)oxy]anilino]pyrimidin-4-yl]amino]-N-cyclopentyl-benzenesulfonamide Formula: C29H37ClN6O4S MolecularWeight: 601.15988

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)OC2CCN(CC2)C)NC3=NC=C(C(=N3)NC4=CC=CC=C4S(=O)(=O)NC5CCCC5)Cl

Isomeric SMILES

CCOC1=C(C=CC(=C1)OC2CCN(CC2)C)NC3=NC=C(C(=N3)NC4=CC=CC=C4S(=O)(=O)NC5CCCC5)Cl

InChI

InChI=1S/C29H37ClN6O4S/c1-3-39-26-18-22(40-21-14-16-36(2)17-15-21)12-13-24(26)33-29-31-19-23(30)28(34-29)32-25-10-6-7-11-27(25)41(37,38)35-20-8-4-5-9-20/h6-7,10-13,18-21,35H,3-5,8-9,14-17H2,1-2H3,(H2,31,32,33,34)