N-(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-3-(2-methylphenyl)-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: N-(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-3-(2-methylphenyl)-1-phenyl-pyrazole-4-carboxamide Openeye Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-3-(o-tolyl)-1-phenyl-pyrazole-4-carboxamide CAS Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-3-(2-methylphenyl)-1-phenyl-4-pyrazolecarboxamide IUPAC Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-3-(2-methylphenyl)-1-phenylpyrazole-4-carboxamide Traditional Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-3-(o-tolyl)-1-phenyl-pyrazole-4-carboxamide Formula: C25H20BrN3O3 MolecularWeight: 490.3486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NN(C=C2C(=O)NC3=CC4=C(C=C3Br)OCCO4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=CC=C1C2=NN(C=C2C(=O)NC3=CC4=C(C=C3Br)OCCO4)C5=CC=CC=C5

InChI

InChI=1S/C25H20BrN3O3/c1-16-7-5-6-10-18(16)24-19(15-29(28-24)17-8-3-2-4-9-17)25(30)27-21-14-23-22(13-20(21)26)31-11-12-32-23/h2-10,13-15H,11-12H2,1H3,(H,27,30)