6-bromanyl-N-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2H-chromene-3-carboxamide

Systemtic Name: 6-bromanyl-N-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2H-chromene-3-carboxamide Openeye Name: 6-bromo-N-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2H-chromene-3-carboxamide CAS Name: 6-bromo-N-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-2H-1-benzopyran-3-carboxamide IUPAC Name: 6-bromo-N-(3,5-dimethyl-1-phenylpyrazol-4-yl)-2H-chromene-3-carboxamide Traditional Name: 6-bromo-N-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2H-chromene-3-carboxamide Formula: C21H18BrN3O2 MolecularWeight: 424.29052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)NC(=O)C3=CC4=C(C=CC(=C4)Br)OC3

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)NC(=O)C3=CC4=C(C=CC(=C4)Br)OC3

InChI

InChI=1S/C21H18BrN3O2/c1-13-20(14(2)25(24-13)18-6-4-3-5-7-18)23-21(26)16-10-15-11-17(22)8-9-19(15)27-12-16/h3-11H,12H2,1-2H3,(H,23,26)