N-[2-(4-chlorophenyl)sulfanylphenyl]-4-iodanyl-1-methyl-pyrazole-3-carboxamide

Systemtic Name: N-[2-(4-chlorophenyl)sulfanylphenyl]-4-iodanyl-1-methyl-pyrazole-3-carboxamide Openeye Name: N-[2-(4-chlorophenyl)sulfanylphenyl]-4-iodo-1-methyl-pyrazole-3-carboxamide CAS Name: N-[2-[(4-chlorophenyl)thio]phenyl]-4-iodo-1-methyl-3-pyrazolecarboxamide IUPAC Name: N-[2-(4-chlorophenyl)sulfanylphenyl]-4-iodo-1-methylpyrazole-3-carboxamide Traditional Name: N-[2-[(4-chlorophenyl)thio]phenyl]-4-iodo-1-methyl-pyrazole-3-carboxamide Formula: C17H13ClIN3OS MolecularWeight: 469.72709

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C(=O)NC2=CC=CC=C2SC3=CC=C(C=C3)Cl)I

Isomeric SMILES

CN1C=C(C(=N1)C(=O)NC2=CC=CC=C2SC3=CC=C(C=C3)Cl)I

InChI

InChI=1S/C17H13ClIN3OS/c1-22-10-13(19)16(21-22)17(23)20-14-4-2-3-5-15(14)24-12-8-6-11(18)7-9-12/h2-10H,1H3,(H,20,23)