N-(2,4-dimethylphenyl)-1-(3-iodanylphenyl)carbonyl-pyrazole-3-carboxamide

Systemtic Name: N-(2,4-dimethylphenyl)-1-(3-iodanylphenyl)carbonyl-pyrazole-3-carboxamide Openeye Name: N-(2,4-dimethylphenyl)-1-(3-iodobenzoyl)pyrazole-3-carboxamide CAS Name: N-(2,4-dimethylphenyl)-1-[(3-iodophenyl)-oxomethyl]-3-pyrazolecarboxamide IUPAC Name: N-(2,4-dimethylphenyl)-1-(3-iodobenzoyl)pyrazole-3-carboxamide Traditional Name: N-(2,4-dimethylphenyl)-1-(3-iodobenzoyl)pyrazole-3-carboxamide Formula: C19H16IN3O2 MolecularWeight: 445.25371

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C2=NN(C=C2)C(=O)C3=CC(=CC=C3)I)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C2=NN(C=C2)C(=O)C3=CC(=CC=C3)I)C

InChI

InChI=1S/C19H16IN3O2/c1-12-6-7-16(13(2)10-12)21-18(24)17-8-9-23(22-17)19(25)14-4-3-5-15(20)11-14/h3-11H,1-2H3,(H,21,24)