2-chloranyl-4-methylsulfanyl-3-[5-(phenylmethyl)-2-(trifluoromethyl)pyrimidin-4-yl]benzenesulfonamide

Systemtic Name: 2-chloranyl-4-methylsulfanyl-3-[5-(phenylmethyl)-2-(trifluoromethyl)pyrimidin-4-yl]benzenesulfonamide Openeye Name: 3-[5-benzyl-2-(trifluoromethyl)pyrimidin-4-yl]-2-chloro-4-methylsulfanyl-benzenesulfonamide CAS Name: 2-chloro-4-(methylthio)-3-[5-(phenylmethyl)-2-(trifluoromethyl)-4-pyrimidinyl]benzenesulfonamide IUPAC Name: 3-[5-benzyl-2-(trifluoromethyl)pyrimidin-4-yl]-2-chloro-4-methylsulfanylbenzenesulfonamide Traditional Name: 3-[5-benzyl-2-(trifluoromethyl)pyrimidin-4-yl]-2-chloro-4-(methylthio)benzenesulfonamide Formula: C19H15ClF3N3O2S2 MolecularWeight: 473.91951

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C(=C(C=C1)S(=O)(=O)N)Cl)C2=NC(=NC=C2CC3=CC=CC=C3)C(F)(F)F

Isomeric SMILES

CSC1=C(C(=C(C=C1)S(=O)(=O)N)Cl)C2=NC(=NC=C2CC3=CC=CC=C3)C(F)(F)F

InChI

InChI=1S/C19H15ClF3N3O2S2/c1-29-13-7-8-14(30(24,27)28)16(20)15(13)17-12(9-11-5-3-2-4-6-11)10-25-18(26-17)19(21,22)23/h2-8,10H,9H2,1H3,(H2,24,27,28)