3-[4-(furan-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-N-(thiophen-2-ylmethyl)propanamide

Systemtic Name: 3-[4-(furan-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-N-(thiophen-2-ylmethyl)propanamide Openeye Name: 3-[4-(2-furyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-N-(2-thienylmethyl)propanamide CAS Name: 3-[[4-(2-furanyl)-6-(trifluoromethyl)-2-pyrimidinyl]thio]-N-(thiophen-2-ylmethyl)propanamide IUPAC Name: 3-[4-(furan-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-N-(thiophen-2-ylmethyl)propanamide Traditional Name: 3-[[4-(2-furyl)-6-(trifluoromethyl)pyrimidin-2-yl]thio]-N-(2-thenyl)propionamide Formula: C17H14F3N3O2S2 MolecularWeight: 413.43717

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C2=CC(=NC(=N2)SCCC(=O)NCC3=CC=CS3)C(F)(F)F

Isomeric SMILES

C1=COC(=C1)C2=CC(=NC(=N2)SCCC(=O)NCC3=CC=CS3)C(F)(F)F

InChI

InChI=1S/C17H14F3N3O2S2/c18-17(19,20)14-9-12(13-4-1-6-25-13)22-16(23-14)27-8-5-15(24)21-10-11-3-2-7-26-11/h1-4,6-7,9H,5,8,10H2,(H,21,24)