1-(4-fluorophenyl)-N-[2-(4-methylsulfanylphenyl)ethyl]-5-pyrrol-1-yl-pyrazole-4-carboxamide

Systemtic Name: 1-(4-fluorophenyl)-N-[2-(4-methylsulfanylphenyl)ethyl]-5-pyrrol-1-yl-pyrazole-4-carboxamide Openeye Name: 1-(4-fluorophenyl)-N-[2-(4-methylsulfanylphenyl)ethyl]-5-pyrrol-1-yl-pyrazole-4-carboxamide CAS Name: 1-(4-fluorophenyl)-N-[2-[4-(methylthio)phenyl]ethyl]-5-(1-pyrrolyl)-4-pyrazolecarboxamide IUPAC Name: 1-(4-fluorophenyl)-N-[2-(4-methylsulfanylphenyl)ethyl]-5-pyrrol-1-ylpyrazole-4-carboxamide Traditional Name: 1-(4-fluorophenyl)-N-[2-[4-(methylthio)phenyl]ethyl]-5-pyrrol-1-yl-pyrazole-4-carboxamide Formula: C23H21FN4OS MolecularWeight: 420.502443

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)CCNC(=O)C2=C(N(N=C2)C3=CC=C(C=C3)F)N4C=CC=C4

Isomeric SMILES

CSC1=CC=C(C=C1)CCNC(=O)C2=C(N(N=C2)C3=CC=C(C=C3)F)N4C=CC=C4

InChI

InChI=1S/C23H21FN4OS/c1-30-20-10-4-17(5-11-20)12-13-25-22(29)21-16-26-28(19-8-6-18(24)7-9-19)23(21)27-14-2-3-15-27/h2-11,14-16H,12-13H2,1H3,(H,25,29)