N-(3-chloranyl-4-pyrrol-1-yl-phenyl)-2-[4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(3-chloranyl-4-pyrrol-1-yl-phenyl)-2-[4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-ethanamide Openeye Name: N-(3-chloro-4-pyrrol-1-yl-phenyl)-2-[4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-acetamide CAS Name: N-[3-chloro-4-(1-pyrrolyl)phenyl]-2-[[4-phenyl-6-(trifluoromethyl)-2-pyrimidinyl]thio]acetamide IUPAC Name: N-(3-chloro-4-pyrrol-1-ylphenyl)-2-[4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylacetamide Traditional Name: N-(3-chloro-4-pyrrol-1-yl-phenyl)-2-[[4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl]thio]acetamide Formula: C23H16ClF3N4OS MolecularWeight: 488.91255

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=NC(=N2)SCC(=O)NC3=CC(=C(C=C3)N4C=CC=C4)Cl)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=NC(=N2)SCC(=O)NC3=CC(=C(C=C3)N4C=CC=C4)Cl)C(F)(F)F

InChI

InChI=1S/C23H16ClF3N4OS/c24-17-12-16(8-9-19(17)31-10-4-5-11-31)28-21(32)14-33-22-29-18(15-6-2-1-3-7-15)13-20(30-22)23(25,26)27/h1-13H,14H2,(H,28,32)