4-bromanyl-N-[2-(4-chlorophenyl)sulfanylphenyl]-1-ethyl-pyrazole-3-carboxamide

Systemtic Name: 4-bromanyl-N-[2-(4-chlorophenyl)sulfanylphenyl]-1-ethyl-pyrazole-3-carboxamide Openeye Name: 4-bromo-N-[2-(4-chlorophenyl)sulfanylphenyl]-1-ethyl-pyrazole-3-carboxamide CAS Name: 4-bromo-N-[2-[(4-chlorophenyl)thio]phenyl]-1-ethyl-3-pyrazolecarboxamide IUPAC Name: 4-bromo-N-[2-(4-chlorophenyl)sulfanylphenyl]-1-ethylpyrazole-3-carboxamide Traditional Name: 4-bromo-N-[2-[(4-chlorophenyl)thio]phenyl]-1-ethyl-pyrazole-3-carboxamide Formula: C18H15BrClN3OS MolecularWeight: 436.7532

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)NC2=CC=CC=C2SC3=CC=C(C=C3)Cl)Br

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)NC2=CC=CC=C2SC3=CC=C(C=C3)Cl)Br

InChI

InChI=1S/C18H15BrClN3OS/c1-2-23-11-14(19)17(22-23)18(24)21-15-5-3-4-6-16(15)25-13-9-7-12(20)8-10-13/h3-11H,2H2,1H3,(H,21,24)