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

Systemtic Name: 5-[[4-[(3-chloranyl-4-methoxy-phenyl)-methyl-amino]-5-fluoranyl-pyrimidin-2-yl]amino]-2-methyl-benzenesulfonamide Openeye Name: 5-[[4-(3-chloro-4-methoxy-N-methyl-anilino)-5-fluoro-pyrimidin-2-yl]amino]-2-methyl-benzenesulfonamide CAS Name: 5-[[4-(3-chloro-4-methoxy-N-methylanilino)-5-fluoro-2-pyrimidinyl]amino]-2-methylbenzenesulfonamide IUPAC Name: 5-[[4-(3-chloro-4-methoxy-N-methylanilino)-5-fluoropyrimidin-2-yl]amino]-2-methylbenzenesulfonamide Traditional Name: 5-[[4-(3-chloro-4-methoxy-N-methyl-anilino)-5-fluoro-pyrimidin-2-yl]amino]-2-methyl-benzenesulfonamide Formula: C19H19ClFN5O3S MolecularWeight: 451.902263

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19ClFN5O3S/c1-11-4-5-12(8-17(11)30(22,27)28)24-19-23-10-15(21)18(25-19)26(2)13-6-7-16(29-3)14(20)9-13/h4-10H,1-3H3,(H2,22,27,28)(H,23,24,25)