1-[5-(1,3-benzoxazol-2-yl)-2-methoxy-phenyl]-3-[(4-fluorophenyl)methyl]urea

Systemtic Name: 1-[5-(1,3-benzoxazol-2-yl)-2-methoxy-phenyl]-3-[(4-fluorophenyl)methyl]urea Openeye Name: 1-[5-(1,3-benzoxazol-2-yl)-2-methoxy-phenyl]-3-[(4-fluorophenyl)methyl]urea CAS Name: 1-[5-(1,3-benzoxazol-2-yl)-2-methoxyphenyl]-3-[(4-fluorophenyl)methyl]urea IUPAC Name: 1-[5-(1,3-benzoxazol-2-yl)-2-methoxyphenyl]-3-[(4-fluorophenyl)methyl]urea Traditional Name: 1-[5-(1,3-benzoxazol-2-yl)-2-methoxy-phenyl]-3-(4-fluorobenzyl)urea Formula: C22H18FN3O3 MolecularWeight: 391.395023

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC3=CC=CC=C3O2)NC(=O)NCC4=CC=C(C=C4)F

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC3=CC=CC=C3O2)NC(=O)NCC4=CC=C(C=C4)F

InChI

InChI=1S/C22H18FN3O3/c1-28-19-11-8-15(21-25-17-4-2-3-5-20(17)29-21)12-18(19)26-22(27)24-13-14-6-9-16(23)10-7-14/h2-12H,13H2,1H3,(H2,24,26,27)