3-(4-bromanyl-3-methyl-pyrazol-1-yl)-N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]propanamide

Systemtic Name: 3-(4-bromanyl-3-methyl-pyrazol-1-yl)-N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]propanamide Openeye Name: 3-(4-bromo-3-methyl-pyrazol-1-yl)-N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]propanamide CAS Name: 3-(4-bromo-3-methyl-1-pyrazolyl)-N-[1-(2-diethylaminoethyl)-2-benzimidazolyl]propanamide IUPAC Name: 3-(4-bromo-3-methylpyrazol-1-yl)-N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]propanamide Traditional Name: 3-(4-bromo-3-methyl-pyrazol-1-yl)-N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]propionamide Formula: C20H27BrN6O MolecularWeight: 447.37198

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN1C2=CC=CC=C2N=C1NC(=O)CCN3C=C(C(=N3)C)Br

Isomeric SMILES

CCN(CC)CCN1C2=CC=CC=C2N=C1NC(=O)CCN3C=C(C(=N3)C)Br

InChI

InChI=1S/C20H27BrN6O/c1-4-25(5-2)12-13-27-18-9-7-6-8-17(18)22-20(27)23-19(28)10-11-26-14-16(21)15(3)24-26/h6-9,14H,4-5,10-13H2,1-3H3,(H,22,23,28)