4-[[4-fluoranyl-2-(1-methylsulfonylpiperidin-4-yl)oxy-phenyl]amino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: 4-[[4-fluoranyl-2-(1-methylsulfonylpiperidin-4-yl)oxy-phenyl]amino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: 4-[4-fluoro-2-[(1-methylsulfonyl-4-piperidyl)oxy]anilino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: 4-[4-fluoro-2-[(1-methylsulfonyl-4-piperidinyl)oxy]anilino]-5-methyl-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: 4-[4-fluoro-2-(1-methylsulfonylpiperidin-4-yl)oxyanilino]-5-methylthieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: 4-[4-fluoro-2-[(1-mesyl-4-piperidyl)oxy]anilino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C20H22FN5O4S2 MolecularWeight: 479.548183

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)NC3=C(C=C(C=C3)F)OC4CCN(CC4)S(=O)(=O)C)C(=O)N

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)NC3=C(C=C(C=C3)F)OC4CCN(CC4)S(=O)(=O)C)C(=O)N

InChI

InChI=1S/C20H22FN5O4S2/c1-11-16-19(23-10-24-20(16)31-17(11)18(22)27)25-14-4-3-12(21)9-15(14)30-13-5-7-26(8-6-13)32(2,28)29/h3-4,9-10,13H,5-8H2,1-2H3,(H2,22,27)(H,23,24,25)