1-[3-[(3R,4R)-1-ethylsulfonyl-4-methoxy-pyrrolidin-3-yl]oxy-5-fluoranyl-phenyl]-3-(6-methylpyridin-3-yl)urea

Systemtic Name: 1-[3-[(3R,4R)-1-ethylsulfonyl-4-methoxy-pyrrolidin-3-yl]oxy-5-fluoranyl-phenyl]-3-(6-methylpyridin-3-yl)urea Openeye Name: 1-[3-[(3R,4R)-1-ethylsulfonyl-4-methoxy-pyrrolidin-3-yl]oxy-5-fluoro-phenyl]-3-(6-methyl-3-pyridyl)urea CAS Name: 1-[3-[[(3R,4R)-1-ethylsulfonyl-4-methoxy-3-pyrrolidinyl]oxy]-5-fluorophenyl]-3-(6-methyl-3-pyridinyl)urea IUPAC Name: 1-[3-[(3R,4R)-1-ethylsulfonyl-4-methoxypyrrolidin-3-yl]oxy-5-fluorophenyl]-3-(6-methylpyridin-3-yl)urea Traditional Name: 1-[3-[(3R,4R)-1-esyl-4-methoxy-pyrrolidin-3-yl]oxy-5-fluoro-phenyl]-3-(6-methyl-3-pyridyl)urea Formula: C20H25FN4O5S MolecularWeight: 452.499703

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CC(C(C1)OC2=CC(=CC(=C2)NC(=O)NC3=CN=C(C=C3)C)F)OC

Isomeric SMILES

CCS(=O)(=O)N1C[C@H]([C@@H](C1)OC2=CC(=CC(=C2)NC(=O)NC3=CN=C(C=C3)C)F)OC

InChI

InChI=1S/C20H25FN4O5S/c1-4-31(27,28)25-11-18(29-3)19(12-25)30-17-8-14(21)7-16(9-17)24-20(26)23-15-6-5-13(2)22-10-15/h5-10,18-19H,4,11-12H2,1-3H3,(H2,23,24,26)/t18-,19-/m1/s1