5-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]-N-(1-propylbenzimidazol-2-yl)furan-2-carboxamide

Systemtic Name: 5-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]-N-(1-propylbenzimidazol-2-yl)furan-2-carboxamide Openeye Name: 5-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]-N-(1-propylbenzimidazol-2-yl)furan-2-carboxamide CAS Name: 5-[(4-bromo-3,5-dimethyl-1-pyrazolyl)methyl]-N-(1-propyl-2-benzimidazolyl)-2-furancarboxamide IUPAC Name: 5-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-N-(1-propylbenzimidazol-2-yl)furan-2-carboxamide Traditional Name: 5-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]-N-(1-propylbenzimidazol-2-yl)-2-furamide Formula: C21H22BrN5O2 MolecularWeight: 456.33568

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=CC=CC=C2N=C1NC(=O)C3=CC=C(O3)CN4C(=C(C(=N4)C)Br)C

Isomeric SMILES

CCCN1C2=CC=CC=C2N=C1NC(=O)C3=CC=C(O3)CN4C(=C(C(=N4)C)Br)C

InChI

InChI=1S/C21H22BrN5O2/c1-4-11-26-17-8-6-5-7-16(17)23-21(26)24-20(28)18-10-9-15(29-18)12-27-14(3)19(22)13(2)25-27/h5-10H,4,11-12H2,1-3H3,(H,23,24,28)