4-bromanyl-1-ethyl-N-[(4-iodanyl-2-methyl-phenyl)carbamothioyl]pyrazole-3-carboxamide

Systemtic Name: 4-bromanyl-1-ethyl-N-[(4-iodanyl-2-methyl-phenyl)carbamothioyl]pyrazole-3-carboxamide Openeye Name: 4-bromo-1-ethyl-N-[(4-iodo-2-methyl-phenyl)carbamothioyl]pyrazole-3-carboxamide CAS Name: 4-bromo-1-ethyl-N-[(4-iodo-2-methylanilino)-sulfanylidenemethyl]-3-pyrazolecarboxamide IUPAC Name: 4-bromo-1-ethyl-N-[(4-iodo-2-methylphenyl)carbamothioyl]pyrazole-3-carboxamide Traditional Name: 4-bromo-1-ethyl-N-[(4-iodo-2-methyl-phenyl)thiocarbamoyl]pyrazole-3-carboxamide Formula: C14H14BrIN4OS MolecularWeight: 493.16063

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)NC(=S)NC2=C(C=C(C=C2)I)C)Br

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)NC(=S)NC2=C(C=C(C=C2)I)C)Br

InChI

InChI=1S/C14H14BrIN4OS/c1-3-20-7-10(15)12(19-20)13(21)18-14(22)17-11-5-4-9(16)6-8(11)2/h4-7H,3H2,1-2H3,(H2,17,18,21,22)