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

Systemtic Name: N-(1,3-benzodioxol-5-yl)-1-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]pyrazole-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-1-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]pyrazole-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-1-[(4-bromo-3,5-dimethyl-1-pyrazolyl)methyl]-3-pyrazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-1-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]pyrazole-3-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-1-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]pyrazole-3-carboxamide Formula: C17H16BrN5O3 MolecularWeight: 418.24464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CN2C=CC(=N2)C(=O)NC3=CC4=C(C=C3)OCO4)C)Br

Isomeric SMILES

CC1=C(C(=NN1CN2C=CC(=N2)C(=O)NC3=CC4=C(C=C3)OCO4)C)Br

InChI

InChI=1S/C17H16BrN5O3/c1-10-16(18)11(2)23(20-10)8-22-6-5-13(21-22)17(24)19-12-3-4-14-15(7-12)26-9-25-14/h3-7H,8-9H2,1-2H3,(H,19,24)