N-[2-(4-butylphenyl)benzotriazol-5-yl]-5-(3-chloranyl-4-fluoranyl-phenyl)furan-2-carboxamide

Systemtic Name: N-[2-(4-butylphenyl)benzotriazol-5-yl]-5-(3-chloranyl-4-fluoranyl-phenyl)furan-2-carboxamide Openeye Name: N-[2-(4-butylphenyl)benzotriazol-5-yl]-5-(3-chloro-4-fluoro-phenyl)furan-2-carboxamide CAS Name: N-[2-(4-butylphenyl)-5-benzotriazolyl]-5-(3-chloro-4-fluorophenyl)-2-furancarboxamide IUPAC Name: N-[2-(4-butylphenyl)benzotriazol-5-yl]-5-(3-chloro-4-fluorophenyl)furan-2-carboxamide Traditional Name: N-[2-(4-butylphenyl)benzotriazol-5-yl]-5-(3-chloro-4-fluoro-phenyl)-2-furamide Formula: C27H22ClFN4O2 MolecularWeight: 488.940583

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=O)C4=CC=C(O4)C5=CC(=C(C=C5)F)Cl

Isomeric SMILES

CCCCC1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=O)C4=CC=C(O4)C5=CC(=C(C=C5)F)Cl

InChI

InChI=1S/C27H22ClFN4O2/c1-2-3-4-17-5-9-20(10-6-17)33-31-23-12-8-19(16-24(23)32-33)30-27(34)26-14-13-25(35-26)18-7-11-22(29)21(28)15-18/h5-16H,2-4H2,1H3,(H,30,34)