4-acetamido-1-[(6-bromanyl-1,3-benzodioxol-5-yl)methyl]-5-methyl-pyrazole-3-carboxamide

Systemtic Name: 4-acetamido-1-[(6-bromanyl-1,3-benzodioxol-5-yl)methyl]-5-methyl-pyrazole-3-carboxamide Openeye Name: 4-acetamido-1-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-5-methyl-pyrazole-3-carboxamide CAS Name: 4-acetamido-1-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-5-methyl-3-pyrazolecarboxamide IUPAC Name: 4-acetamido-1-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-5-methylpyrazole-3-carboxamide Traditional Name: 4-acetamido-1-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-5-methyl-pyrazole-3-carboxamide Formula: C15H15BrN4O4 MolecularWeight: 395.208

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC3=C(C=C2Br)OCO3)C(=O)N)NC(=O)C

Isomeric SMILES

CC1=C(C(=NN1CC2=CC3=C(C=C2Br)OCO3)C(=O)N)NC(=O)C

InChI

InChI=1S/C15H15BrN4O4/c1-7-13(18-8(2)21)14(15(17)22)19-20(7)5-9-3-11-12(4-10(9)16)24-6-23-11/h3-4H,5-6H2,1-2H3,(H2,17,22)(H,18,21)