4-bromanyl-2,5-dimethyl-N-[1-(phenylmethyl)-1,2,4-triazol-3-yl]pyrazole-3-carboxamide

Systemtic Name: 4-bromanyl-2,5-dimethyl-N-[1-(phenylmethyl)-1,2,4-triazol-3-yl]pyrazole-3-carboxamide Openeye Name: N-(1-benzyl-1,2,4-triazol-3-yl)-4-bromo-2,5-dimethyl-pyrazole-3-carboxamide CAS Name: 4-bromo-2,5-dimethyl-N-[1-(phenylmethyl)-1,2,4-triazol-3-yl]-3-pyrazolecarboxamide IUPAC Name: N-(1-benzyl-1,2,4-triazol-3-yl)-4-bromo-2,5-dimethylpyrazole-3-carboxamide Traditional Name: N-(1-benzyl-1,2,4-triazol-3-yl)-4-bromo-2,5-dimethyl-pyrazole-3-carboxamide Formula: C15H15BrN6O MolecularWeight: 375.2232

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1Br)C(=O)NC2=NN(C=N2)CC3=CC=CC=C3)C

Isomeric SMILES

CC1=NN(C(=C1Br)C(=O)NC2=NN(C=N2)CC3=CC=CC=C3)C

InChI

InChI=1S/C15H15BrN6O/c1-10-12(16)13(21(2)19-10)14(23)18-15-17-9-22(20-15)8-11-6-4-3-5-7-11/h3-7,9H,8H2,1-2H3,(H,18,20,23)