2-(4-bromanylpyrazol-1-yl)-N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]butanamide

Systemtic Name: 2-(4-bromanylpyrazol-1-yl)-N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]butanamide Openeye Name: 2-(4-bromopyrazol-1-yl)-N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]butanamide CAS Name: 2-(4-bromo-1-pyrazolyl)-N-[1-(2-diethylaminoethyl)-2-benzimidazolyl]butanamide IUPAC Name: 2-(4-bromopyrazol-1-yl)-N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]butanamide Traditional Name: 2-(4-bromopyrazol-1-yl)-N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]butyramide Formula: C20H27BrN6O MolecularWeight: 447.37198

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NC2=CC=CC=C2N1CCN(CC)CC)N3C=C(C=N3)Br

Isomeric SMILES

CCC(C(=O)NC1=NC2=CC=CC=C2N1CCN(CC)CC)N3C=C(C=N3)Br

InChI

InChI=1S/C20H27BrN6O/c1-4-17(27-14-15(21)13-22-27)19(28)24-20-23-16-9-7-8-10-18(16)26(20)12-11-25(5-2)6-3/h7-10,13-14,17H,4-6,11-12H2,1-3H3,(H,23,24,28)