N-(1,3-benzodioxol-5-ylmethyl)-1-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]pyrazole-3-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-1-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]pyrazole-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-1-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]pyrazole-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-1-[(4-bromo-3,5-dimethyl-1-pyrazolyl)methyl]-3-pyrazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-1-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]pyrazole-3-carboxamide Traditional Name: 1-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]-N-piperonyl-pyrazole-3-carboxamide Formula: C18H18BrN5O3 MolecularWeight: 432.27122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CN2C=CC(=N2)C(=O)NCC3=CC4=C(C=C3)OCO4)C)Br

Isomeric SMILES

CC1=C(C(=NN1CN2C=CC(=N2)C(=O)NCC3=CC4=C(C=C3)OCO4)C)Br

InChI

InChI=1S/C18H18BrN5O3/c1-11-17(19)12(2)24(21-11)9-23-6-5-14(22-23)18(25)20-8-13-3-4-15-16(7-13)27-10-26-15/h3-7H,8-10H2,1-2H3,(H,20,25)