5-[[4-[(4-chloranyl-3-methoxy-phenyl)amino]-5-fluoranyl-pyrimidin-2-yl]amino]-2-methyl-benzenesulfonamide

Systemtic Name: 5-[[4-[(4-chloranyl-3-methoxy-phenyl)amino]-5-fluoranyl-pyrimidin-2-yl]amino]-2-methyl-benzenesulfonamide Openeye Name: 5-[[4-(4-chloro-3-methoxy-anilino)-5-fluoro-pyrimidin-2-yl]amino]-2-methyl-benzenesulfonamide CAS Name: 5-[[4-(4-chloro-3-methoxyanilino)-5-fluoro-2-pyrimidinyl]amino]-2-methylbenzenesulfonamide IUPAC Name: 5-[[4-(4-chloro-3-methoxyanilino)-5-fluoropyrimidin-2-yl]amino]-2-methylbenzenesulfonamide Traditional Name: 5-[[4-(4-chloro-3-methoxy-anilino)-5-fluoro-pyrimidin-2-yl]amino]-2-methyl-benzenesulfonamide Formula: C18H17ClFN5O3S MolecularWeight: 437.875683

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2=NC=C(C(=N2)NC3=CC(=C(C=C3)Cl)OC)F)S(=O)(=O)N

Isomeric SMILES

CC1=C(C=C(C=C1)NC2=NC=C(C(=N2)NC3=CC(=C(C=C3)Cl)OC)F)S(=O)(=O)N

InChI

InChI=1S/C18H17ClFN5O3S/c1-10-3-4-12(8-16(10)29(21,26)27)24-18-22-9-14(20)17(25-18)23-11-5-6-13(19)15(7-11)28-2/h3-9H,1-2H3,(H2,21,26,27)(H2,22,23,24,25)