(4-bromanyl-2-methyl-pyrazol-3-yl)-[2-(1-methylpyrazol-4-yl)azepan-1-yl]methanone

Systemtic Name: (4-bromanyl-2-methyl-pyrazol-3-yl)-[2-(1-methylpyrazol-4-yl)azepan-1-yl]methanone Openeye Name: (4-bromo-2-methyl-pyrazol-3-yl)-[2-(1-methylpyrazol-4-yl)azepan-1-yl]methanone CAS Name: (4-bromo-2-methyl-3-pyrazolyl)-[2-(1-methyl-4-pyrazolyl)-1-azepanyl]methanone IUPAC Name: (4-bromo-2-methylpyrazol-3-yl)-[2-(1-methylpyrazol-4-yl)azepan-1-yl]methanone Traditional Name: (4-bromo-2-methyl-pyrazol-3-yl)-[2-(1-methylpyrazol-4-yl)azepan-1-yl]methanone Formula: C15H20BrN5O MolecularWeight: 366.2562

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C2CCCCCN2C(=O)C3=C(C=NN3C)Br

Isomeric SMILES

CN1C=C(C=N1)C2CCCCCN2C(=O)C3=C(C=NN3C)Br

InChI

InChI=1S/C15H20BrN5O/c1-19-10-11(8-17-19)13-6-4-3-5-7-21(13)15(22)14-12(16)9-18-20(14)2/h8-10,13H,3-7H2,1-2H3