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

Systemtic Name: 5-(4-bromophenyl)-N-[2-(4-butylphenyl)-6-chloranyl-benzotriazol-5-yl]furan-2-carboxamide Openeye Name: 5-(4-bromophenyl)-N-[2-(4-butylphenyl)-6-chloro-benzotriazol-5-yl]furan-2-carboxamide CAS Name: 5-(4-bromophenyl)-N-[2-(4-butylphenyl)-6-chloro-5-benzotriazolyl]-2-furancarboxamide IUPAC Name: 5-(4-bromophenyl)-N-[2-(4-butylphenyl)-6-chlorobenzotriazol-5-yl]furan-2-carboxamide Traditional Name: 5-(4-bromophenyl)-N-[2-(4-butylphenyl)-6-chloro-benzotriazol-5-yl]-2-furamide Formula: C27H22BrClN4O2 MolecularWeight: 549.84618

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H22BrClN4O2/c1-2-3-4-17-5-11-20(12-6-17)33-31-23-15-21(29)22(16-24(23)32-33)30-27(34)26-14-13-25(35-26)18-7-9-19(28)10-8-18/h5-16H,2-4H2,1H3,(H,30,34)