5-bromanyl-N-[6-methyl-2-(4-propan-2-ylphenyl)benzotriazol-5-yl]furan-2-carboxamide

Systemtic Name: 5-bromanyl-N-[6-methyl-2-(4-propan-2-ylphenyl)benzotriazol-5-yl]furan-2-carboxamide Openeye Name: 5-bromo-N-[2-(4-isopropylphenyl)-6-methyl-benzotriazol-5-yl]furan-2-carboxamide CAS Name: 5-bromo-N-[6-methyl-2-(4-propan-2-ylphenyl)-5-benzotriazolyl]-2-furancarboxamide IUPAC Name: 5-bromo-N-[6-methyl-2-(4-propan-2-ylphenyl)benzotriazol-5-yl]furan-2-carboxamide Traditional Name: 5-bromo-N-(6-methyl-2-p-cumenyl-benzotriazol-5-yl)-2-furamide Formula: C21H19BrN4O2 MolecularWeight: 439.30516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NN(N=C2C=C1NC(=O)C3=CC=C(O3)Br)C4=CC=C(C=C4)C(C)C

Isomeric SMILES

CC1=CC2=NN(N=C2C=C1NC(=O)C3=CC=C(O3)Br)C4=CC=C(C=C4)C(C)C

InChI

InChI=1S/C21H19BrN4O2/c1-12(2)14-4-6-15(7-5-14)26-24-17-10-13(3)16(11-18(17)25-26)23-21(27)19-8-9-20(22)28-19/h4-12H,1-3H3,(H,23,27)