1-(3-bromophenyl)-N-methyl-N-[[1-(phenylmethyl)pyrazol-4-yl]methyl]-1,2,3-triazole-4-carboxamide

Systemtic Name: 1-(3-bromophenyl)-N-methyl-N-[[1-(phenylmethyl)pyrazol-4-yl]methyl]-1,2,3-triazole-4-carboxamide Openeye Name: N-[(1-benzylpyrazol-4-yl)methyl]-1-(3-bromophenyl)-N-methyl-triazole-4-carboxamide CAS Name: 1-(3-bromophenyl)-N-methyl-N-[[1-(phenylmethyl)-4-pyrazolyl]methyl]-4-triazolecarboxamide IUPAC Name: N-[(1-benzylpyrazol-4-yl)methyl]-1-(3-bromophenyl)-N-methyltriazole-4-carboxamide Traditional Name: N-[(1-benzylpyrazol-4-yl)methyl]-1-(3-bromophenyl)-N-methyl-triazole-4-carboxamide Formula: C21H19BrN6O MolecularWeight: 451.31916

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CN(N=C1)CC2=CC=CC=C2)C(=O)C3=CN(N=N3)C4=CC(=CC=C4)Br

Isomeric SMILES

CN(CC1=CN(N=C1)CC2=CC=CC=C2)C(=O)C3=CN(N=N3)C4=CC(=CC=C4)Br

InChI

InChI=1S/C21H19BrN6O/c1-26(12-17-11-23-27(14-17)13-16-6-3-2-4-7-16)21(29)20-15-28(25-24-20)19-9-5-8-18(22)10-19/h2-11,14-15H,12-13H2,1H3