N-[5-[[5-fluoranyl-4-[(4-prop-2-ynoxyphenyl)amino]pyrimidin-2-yl]amino]-2-methyl-phenyl]sulfonyl-2-methyl-propanamide

Systemtic Name: N-[5-[[5-fluoranyl-4-[(4-prop-2-ynoxyphenyl)amino]pyrimidin-2-yl]amino]-2-methyl-phenyl]sulfonyl-2-methyl-propanamide Openeye Name: N-[5-[[5-fluoro-4-(4-prop-2-ynoxyanilino)pyrimidin-2-yl]amino]-2-methyl-phenyl]sulfonyl-2-methyl-propanamide CAS Name: N-[5-[[5-fluoro-4-(4-prop-2-ynoxyanilino)-2-pyrimidinyl]amino]-2-methylphenyl]sulfonyl-2-methylpropanamide IUPAC Name: N-[5-[[5-fluoro-4-(4-prop-2-ynoxyanilino)pyrimidin-2-yl]amino]-2-methylphenyl]sulfonyl-2-methylpropanamide Traditional Name: N-[5-[[5-fluoro-4-(4-propargyloxyanilino)pyrimidin-2-yl]amino]-2-methyl-phenyl]sulfonyl-2-methyl-propionamide Formula: C24H24FN5O4S MolecularWeight: 497.541863

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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)OCC#C)F)S(=O)(=O)NC(=O)C(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC2=NC=C(C(=N2)NC3=CC=C(C=C3)OCC#C)F)S(=O)(=O)NC(=O)C(C)C

InChI

InChI=1S/C24H24FN5O4S/c1-5-12-34-19-10-8-17(9-11-19)27-22-20(25)14-26-24(29-22)28-18-7-6-16(4)21(13-18)35(32,33)30-23(31)15(2)3/h1,6-11,13-15H,12H2,2-4H3,(H,30,31)(H2,26,27,28,29)