N-[[4-(5-butan-2-yl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl]-5-(2-fluorophenyl)furan-2-carboxamide

Systemtic Name: N-[[4-(5-butan-2-yl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl]-5-(2-fluorophenyl)furan-2-carboxamide Openeye Name: 5-(2-fluorophenyl)-N-[[4-(5-sec-butyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl]furan-2-carboxamide CAS Name: N-[[4-(5-butan-2-yl-1,3-benzoxazol-2-yl)anilino]-sulfanylidenemethyl]-5-(2-fluorophenyl)-2-furancarboxamide IUPAC Name: N-[[4-(5-butan-2-yl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl]-5-(2-fluorophenyl)furan-2-carboxamide Traditional Name: 5-(2-fluorophenyl)-N-[[4-(5-sec-butyl-1,3-benzoxazol-2-yl)phenyl]thiocarbamoyl]-2-furamide Formula: C29H24FN3O3S MolecularWeight: 513.582563

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC2=C(C=C1)OC(=N2)C3=CC=C(C=C3)NC(=S)NC(=O)C4=CC=C(O4)C5=CC=CC=C5F

Isomeric SMILES

CCC(C)C1=CC2=C(C=C1)OC(=N2)C3=CC=C(C=C3)NC(=S)NC(=O)C4=CC=C(O4)C5=CC=CC=C5F

InChI

InChI=1S/C29H24FN3O3S/c1-3-17(2)19-10-13-25-23(16-19)32-28(36-25)18-8-11-20(12-9-18)31-29(37)33-27(34)26-15-14-24(35-26)21-6-4-5-7-22(21)30/h4-17H,3H2,1-2H3,(H2,31,33,34,37)