5-(4-bromophenyl)-N-[2-(4-butylphenyl)-6-methyl-benzotriazol-5-yl]furan-2-carboxamide

Systemtic Name: 5-(4-bromophenyl)-N-[2-(4-butylphenyl)-6-methyl-benzotriazol-5-yl]furan-2-carboxamide Openeye Name: 5-(4-bromophenyl)-N-[2-(4-butylphenyl)-6-methyl-benzotriazol-5-yl]furan-2-carboxamide CAS Name: 5-(4-bromophenyl)-N-[2-(4-butylphenyl)-6-methyl-5-benzotriazolyl]-2-furancarboxamide IUPAC Name: 5-(4-bromophenyl)-N-[2-(4-butylphenyl)-6-methylbenzotriazol-5-yl]furan-2-carboxamide Traditional Name: 5-(4-bromophenyl)-N-[2-(4-butylphenyl)-6-methyl-benzotriazol-5-yl]-2-furamide Formula: C28H25BrN4O2 MolecularWeight: 529.4277

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H25BrN4O2/c1-3-4-5-19-6-12-22(13-7-19)33-31-24-16-18(2)23(17-25(24)32-33)30-28(34)27-15-14-26(35-27)20-8-10-21(29)11-9-20/h6-17H,3-5H2,1-2H3,(H,30,34)