2-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)-N-[2-(4-chlorophenyl)sulfanylphenyl]propanamide

Systemtic Name: 2-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)-N-[2-(4-chlorophenyl)sulfanylphenyl]propanamide Openeye Name: 2-(4-bromo-3,5-dimethyl-pyrazol-1-yl)-N-[2-(4-chlorophenyl)sulfanylphenyl]propanamide CAS Name: 2-(4-bromo-3,5-dimethyl-1-pyrazolyl)-N-[2-[(4-chlorophenyl)thio]phenyl]propanamide IUPAC Name: 2-(4-bromo-3,5-dimethylpyrazol-1-yl)-N-[2-(4-chlorophenyl)sulfanylphenyl]propanamide Traditional Name: 2-(4-bromo-3,5-dimethyl-pyrazol-1-yl)-N-[2-[(4-chlorophenyl)thio]phenyl]propionamide Formula: C20H19BrClN3OS MolecularWeight: 464.80636

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C(C)C(=O)NC2=CC=CC=C2SC3=CC=C(C=C3)Cl)C)Br

Isomeric SMILES

CC1=C(C(=NN1C(C)C(=O)NC2=CC=CC=C2SC3=CC=C(C=C3)Cl)C)Br

InChI

InChI=1S/C20H19BrClN3OS/c1-12-19(21)13(2)25(24-12)14(3)20(26)23-17-6-4-5-7-18(17)27-16-10-8-15(22)9-11-16/h4-11,14H,1-3H3,(H,23,26)