4-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)-N-(3,4-dihydro-2H-chromen-4-yl)benzamide

Systemtic Name: 4-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)-N-(3,4-dihydro-2H-chromen-4-yl)benzamide Openeye Name: 4-(4-bromo-3,5-dimethyl-pyrazol-1-yl)-N-chroman-4-yl-benzamide CAS Name: 4-(4-bromo-3,5-dimethyl-1-pyrazolyl)-N-(3,4-dihydro-2H-1-benzopyran-4-yl)benzamide IUPAC Name: 4-(4-bromo-3,5-dimethylpyrazol-1-yl)-N-(3,4-dihydro-2H-chromen-4-yl)benzamide Traditional Name: 4-(4-bromo-3,5-dimethyl-pyrazol-1-yl)-N-chroman-4-yl-benzamide Formula: C21H20BrN3O2 MolecularWeight: 426.3064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=C(C=C2)C(=O)NC3CCOC4=CC=CC=C34)C)Br

Isomeric SMILES

CC1=C(C(=NN1C2=CC=C(C=C2)C(=O)NC3CCOC4=CC=CC=C34)C)Br

InChI

InChI=1S/C21H20BrN3O2/c1-13-20(22)14(2)25(24-13)16-9-7-15(8-10-16)21(26)23-18-11-12-27-19-6-4-3-5-17(18)19/h3-10,18H,11-12H2,1-2H3,(H,23,26)