N-(4-bromanyl-3-methyl-phenyl)-4-(4-iodanyl-3,5-dimethyl-pyrazol-1-yl)butanamide

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-4-(4-iodanyl-3,5-dimethyl-pyrazol-1-yl)butanamide Openeye Name: N-(4-bromo-3-methyl-phenyl)-4-(4-iodo-3,5-dimethyl-pyrazol-1-yl)butanamide CAS Name: N-(4-bromo-3-methylphenyl)-4-(4-iodo-3,5-dimethyl-1-pyrazolyl)butanamide IUPAC Name: N-(4-bromo-3-methylphenyl)-4-(4-iodo-3,5-dimethylpyrazol-1-yl)butanamide Traditional Name: N-(4-bromo-3-methyl-phenyl)-4-(4-iodo-3,5-dimethyl-pyrazol-1-yl)butyramide Formula: C16H19BrIN3O MolecularWeight: 476.15003

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)CCCN2C(=C(C(=N2)C)I)C)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)CCCN2C(=C(C(=N2)C)I)C)Br

InChI

InChI=1S/C16H19BrIN3O/c1-10-9-13(6-7-14(10)17)19-15(22)5-4-8-21-12(3)16(18)11(2)20-21/h6-7,9H,4-5,8H2,1-3H3,(H,19,22)