N-(4-phenylmethoxyphenyl)-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-propanamide

Systemtic Name: N-(4-phenylmethoxyphenyl)-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-propanamide Openeye Name: N-(4-benzyloxyphenyl)-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-propanamide CAS Name: N-(4-phenylmethoxyphenyl)-2-[[4-(trifluoromethyl)-2-pyrimidinyl]thio]propanamide IUPAC Name: N-(4-phenylmethoxyphenyl)-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanylpropanamide Traditional Name: N-(4-benzoxyphenyl)-2-[[4-(trifluoromethyl)pyrimidin-2-yl]thio]propionamide Formula: C21H18F3N3O2S MolecularWeight: 433.44673

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)OCC2=CC=CC=C2)SC3=NC=CC(=N3)C(F)(F)F

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)OCC2=CC=CC=C2)SC3=NC=CC(=N3)C(F)(F)F

InChI

InChI=1S/C21H18F3N3O2S/c1-14(30-20-25-12-11-18(27-20)21(22,23)24)19(28)26-16-7-9-17(10-8-16)29-13-15-5-3-2-4-6-15/h2-12,14H,13H2,1H3,(H,26,28)