N-[(E)-(6-bromanyl-1,3-benzodioxol-5-yl)methylideneamino]-5-methyl-1H-pyrazole-3-carboxamide

Systemtic Name: N-[(E)-(6-bromanyl-1,3-benzodioxol-5-yl)methylideneamino]-5-methyl-1H-pyrazole-3-carboxamide Openeye Name: N-[(E)-(6-bromo-1,3-benzodioxol-5-yl)methyleneamino]-5-methyl-1H-pyrazole-3-carboxamide CAS Name: N-[(E)-(6-bromo-1,3-benzodioxol-5-yl)methylideneamino]-5-methyl-1H-pyrazole-3-carboxamide IUPAC Name: N-[(E)-(6-bromo-1,3-benzodioxol-5-yl)methylideneamino]-5-methyl-1H-pyrazole-3-carboxamide Traditional Name: N-[(E)-(6-bromo-1,3-benzodioxol-5-yl)methyleneamino]-5-methyl-1H-pyrazole-3-carboxamide Formula: C13H11BrN4O3 MolecularWeight: 351.15544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1)C(=O)NN=CC2=CC3=C(C=C2Br)OCO3

Isomeric SMILES

CC1=CC(=NN1)C(=O)N/N=C/C2=CC3=C(C=C2Br)OCO3

InChI

InChI=1S/C13H11BrN4O3/c1-7-2-10(17-16-7)13(19)18-15-5-8-3-11-12(4-9(8)14)21-6-20-11/h2-5H,6H2,1H3,(H,16,17)(H,18,19)/b15-5+