N-(4-bromophenyl)-5-(4-chlorophenyl)-4-(3-methylsulfanylpropyl)-4-phenyl-3H-pyrazole-2-carboxamide

Systemtic Name: N-(4-bromophenyl)-5-(4-chlorophenyl)-4-(3-methylsulfanylpropyl)-4-phenyl-3H-pyrazole-2-carboxamide Openeye Name: N-(4-bromophenyl)-5-(4-chlorophenyl)-4-(3-methylsulfanylpropyl)-4-phenyl-3H-pyrazole-2-carboxamide CAS Name: N-(4-bromophenyl)-5-(4-chlorophenyl)-4-[3-(methylthio)propyl]-4-phenyl-3H-pyrazole-2-carboxamide IUPAC Name: N-(4-bromophenyl)-5-(4-chlorophenyl)-4-(3-methylsulfanylpropyl)-4-phenyl-3H-pyrazole-2-carboxamide Traditional Name: N-(4-bromophenyl)-3-(4-chlorophenyl)-4-[3-(methylthio)propyl]-4-phenyl-2-pyrazoline-1-carboxamide Formula: C26H25BrClN3OS MolecularWeight: 542.9182

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Descriptors Computed from Structure

Canonical SMILES:

CSCCCC1(CN(N=C1C2=CC=C(C=C2)Cl)C(=O)NC3=CC=C(C=C3)Br)C4=CC=CC=C4

Isomeric SMILES

CSCCCC1(CN(N=C1C2=CC=C(C=C2)Cl)C(=O)NC3=CC=C(C=C3)Br)C4=CC=CC=C4

InChI

InChI=1S/C26H25BrClN3OS/c1-33-17-5-16-26(20-6-3-2-4-7-20)18-31(25(32)29-23-14-10-21(27)11-15-23)30-24(26)19-8-12-22(28)13-9-19/h2-4,6-15H,5,16-18H2,1H3,(H,29,32)