1-ethyl-3-[4-fluoranyl-7-(3-fluoranylpyridin-2-yl)-5-(2-pyrrolidin-1-ylpyrimidin-5-yl)-1,3-benzothiazol-2-yl]urea

Systemtic Name: 1-ethyl-3-[4-fluoranyl-7-(3-fluoranylpyridin-2-yl)-5-(2-pyrrolidin-1-ylpyrimidin-5-yl)-1,3-benzothiazol-2-yl]urea Openeye Name: 1-ethyl-3-[4-fluoro-7-(3-fluoro-2-pyridyl)-5-(2-pyrrolidin-1-ylpyrimidin-5-yl)-1,3-benzothiazol-2-yl]urea CAS Name: 1-ethyl-3-[4-fluoro-7-(3-fluoro-2-pyridinyl)-5-[2-(1-pyrrolidinyl)-5-pyrimidinyl]-1,3-benzothiazol-2-yl]urea IUPAC Name: 1-ethyl-3-[4-fluoro-7-(3-fluoropyridin-2-yl)-5-(2-pyrrolidin-1-ylpyrimidin-5-yl)-1,3-benzothiazol-2-yl]urea Traditional Name: 1-ethyl-3-[4-fluoro-7-(3-fluoro-2-pyridyl)-5-(2-pyrrolidinopyrimidin-5-yl)-1,3-benzothiazol-2-yl]urea Formula: C23H21F2N7OS MolecularWeight: 481.520946

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC1=NC2=C(C(=CC(=C2S1)C3=C(C=CC=N3)F)C4=CN=C(N=C4)N5CCCC5)F

Isomeric SMILES

CCNC(=O)NC1=NC2=C(C(=CC(=C2S1)C3=C(C=CC=N3)F)C4=CN=C(N=C4)N5CCCC5)F

InChI

InChI=1S/C23H21F2N7OS/c1-2-26-22(33)31-23-30-19-17(25)14(13-11-28-21(29-12-13)32-8-3-4-9-32)10-15(20(19)34-23)18-16(24)6-5-7-27-18/h5-7,10-12H,2-4,8-9H2,1H3,(H2,26,30,31,33)