4-chloranyl-N-[(4-iodanyl-2-methyl-phenyl)carbamothioyl]-2-methyl-pyrazole-3-carboxamide

Systemtic Name: 4-chloranyl-N-[(4-iodanyl-2-methyl-phenyl)carbamothioyl]-2-methyl-pyrazole-3-carboxamide Openeye Name: 4-chloro-N-[(4-iodo-2-methyl-phenyl)carbamothioyl]-2-methyl-pyrazole-3-carboxamide CAS Name: 4-chloro-N-[(4-iodo-2-methylanilino)-sulfanylidenemethyl]-2-methyl-3-pyrazolecarboxamide IUPAC Name: 4-chloro-N-[(4-iodo-2-methylphenyl)carbamothioyl]-2-methylpyrazole-3-carboxamide Traditional Name: 4-chloro-N-[(4-iodo-2-methyl-phenyl)thiocarbamoyl]-2-methyl-pyrazole-3-carboxamide Formula: C13H12ClIN4OS MolecularWeight: 434.68305

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)I)NC(=S)NC(=O)C2=C(C=NN2C)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)I)NC(=S)NC(=O)C2=C(C=NN2C)Cl

InChI

InChI=1S/C13H12ClIN4OS/c1-7-5-8(15)3-4-10(7)17-13(21)18-12(20)11-9(14)6-16-19(11)2/h3-6H,1-2H3,(H2,17,18,20,21)