N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-4-(4-iodanyl-3,5-dimethyl-pyrazol-1-yl)butanamide

Systemtic Name: N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-4-(4-iodanyl-3,5-dimethyl-pyrazol-1-yl)butanamide Openeye Name: N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-4-(4-iodo-3,5-dimethyl-pyrazol-1-yl)butanamide CAS Name: N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-4-(4-iodo-3,5-dimethyl-1-pyrazolyl)butanamide IUPAC Name: N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-4-(4-iodo-3,5-dimethylpyrazol-1-yl)butanamide Traditional Name: 4-(4-iodo-3,5-dimethyl-pyrazol-1-yl)-N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)butyramide Formula: C20H24IN5O2 MolecularWeight: 493.34133

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)CCCN3C(=C(C(=N3)C)I)C

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)CCCN3C(=C(C(=N3)C)I)C

InChI

InChI=1S/C20H24IN5O2/c1-13-18(21)14(2)25(23-13)12-8-11-17(27)22-19-15(3)24(4)26(20(19)28)16-9-6-5-7-10-16/h5-7,9-10H,8,11-12H2,1-4H3,(H,22,27)