1-[3-[(2R,3S)-1-ethylsulfonyl-2-(methoxymethyl)pyrrolidin-3-yl]oxy-5-fluoranyl-phenyl]-3-(6-methylpyridin-3-yl)urea

Systemtic Name: 1-[3-[(2R,3S)-1-ethylsulfonyl-2-(methoxymethyl)pyrrolidin-3-yl]oxy-5-fluoranyl-phenyl]-3-(6-methylpyridin-3-yl)urea Openeye Name: 1-[3-[(2R,3S)-1-ethylsulfonyl-2-(methoxymethyl)pyrrolidin-3-yl]oxy-5-fluoro-phenyl]-3-(6-methyl-3-pyridyl)urea CAS Name: 1-[3-[[(2R,3S)-1-ethylsulfonyl-2-(methoxymethyl)-3-pyrrolidinyl]oxy]-5-fluorophenyl]-3-(6-methyl-3-pyridinyl)urea IUPAC Name: 1-[3-[(2R,3S)-1-ethylsulfonyl-2-(methoxymethyl)pyrrolidin-3-yl]oxy-5-fluorophenyl]-3-(6-methylpyridin-3-yl)urea Traditional Name: 1-[3-[(2R,3S)-1-esyl-2-(methoxymethyl)pyrrolidin-3-yl]oxy-5-fluoro-phenyl]-3-(6-methyl-3-pyridyl)urea Formula: C21H27FN4O5S MolecularWeight: 466.526283

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCC(C1COC)OC2=CC(=CC(=C2)NC(=O)NC3=CN=C(C=C3)C)F

Isomeric SMILES

CCS(=O)(=O)N1CC[C@@H]([C@H]1COC)OC2=CC(=CC(=C2)NC(=O)NC3=CN=C(C=C3)C)F

InChI

InChI=1S/C21H27FN4O5S/c1-4-32(28,29)26-8-7-20(19(26)13-30-3)31-18-10-15(22)9-17(11-18)25-21(27)24-16-6-5-14(2)23-12-16/h5-6,9-12,19-20H,4,7-8,13H2,1-3H3,(H2,24,25,27)/t19-,20+/m1/s1