1-(4-chloranyl-3,5-dimethyl-pyrazol-1-yl)-4-(4-iodanyl-3,5-dimethyl-pyrazol-1-yl)butan-1-one

Systemtic Name: 1-(4-chloranyl-3,5-dimethyl-pyrazol-1-yl)-4-(4-iodanyl-3,5-dimethyl-pyrazol-1-yl)butan-1-one Openeye Name: 1-(4-chloro-3,5-dimethyl-pyrazol-1-yl)-4-(4-iodo-3,5-dimethyl-pyrazol-1-yl)butan-1-one CAS Name: 1-(4-chloro-3,5-dimethyl-1-pyrazolyl)-4-(4-iodo-3,5-dimethyl-1-pyrazolyl)-1-butanone IUPAC Name: 1-(4-chloro-3,5-dimethylpyrazol-1-yl)-4-(4-iodo-3,5-dimethylpyrazol-1-yl)butan-1-one Traditional Name: 1-(4-chloro-3,5-dimethyl-pyrazol-1-yl)-4-(4-iodo-3,5-dimethyl-pyrazol-1-yl)butan-1-one Formula: C14H18ClIN4O MolecularWeight: 420.67639

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C(=O)CCCN2C(=C(C(=N2)C)I)C)C)Cl

Isomeric SMILES

CC1=C(C(=NN1C(=O)CCCN2C(=C(C(=N2)C)I)C)C)Cl

InChI

InChI=1S/C14H18ClIN4O/c1-8-13(15)10(3)20(18-8)12(21)6-5-7-19-11(4)14(16)9(2)17-19/h5-7H2,1-4H3