butyl 4-[6-[(4-cyclopropylsulfonyl-2-fluoranyl-phenyl)amino]-5-methyl-pyrimidin-4-yl]oxypiperidine-1-carboxylate

Systemtic Name: butyl 4-[6-[(4-cyclopropylsulfonyl-2-fluoranyl-phenyl)amino]-5-methyl-pyrimidin-4-yl]oxypiperidine-1-carboxylate Openeye Name: butyl 4-[6-(4-cyclopropylsulfonyl-2-fluoro-anilino)-5-methyl-pyrimidin-4-yl]oxypiperidine-1-carboxylate CAS Name: 4-[[6-(4-cyclopropylsulfonyl-2-fluoroanilino)-5-methyl-4-pyrimidinyl]oxy]-1-piperidinecarboxylic acid butyl ester IUPAC Name: butyl 4-[6-(4-cyclopropylsulfonyl-2-fluoroanilino)-5-methylpyrimidin-4-yl]oxypiperidine-1-carboxylate Traditional Name: 4-[6-(4-cyclopropylsulfonyl-2-fluoro-anilino)-5-methyl-pyrimidin-4-yl]oxypiperidine-1-carboxylic acid butyl ester Formula: C24H31FN4O5S MolecularWeight: 506.590143

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)N1CCC(CC1)OC2=NC=NC(=C2C)NC3=C(C=C(C=C3)S(=O)(=O)C4CC4)F

Isomeric SMILES

CCCCOC(=O)N1CCC(CC1)OC2=NC=NC(=C2C)NC3=C(C=C(C=C3)S(=O)(=O)C4CC4)F

InChI

InChI=1S/C24H31FN4O5S/c1-3-4-13-33-24(30)29-11-9-17(10-12-29)34-23-16(2)22(26-15-27-23)28-21-8-7-19(14-20(21)25)35(31,32)18-5-6-18/h7-8,14-15,17-18H,3-6,9-13H2,1-2H3,(H,26,27,28)