4-[4-(furan-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-N-prop-2-enyl-butanamide

Systemtic Name: 4-[4-(furan-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-N-prop-2-enyl-butanamide Openeye Name: N-allyl-4-[4-(2-furyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-butanamide CAS Name: 4-[[4-(2-furanyl)-6-(trifluoromethyl)-2-pyrimidinyl]thio]-N-prop-2-enylbutanamide IUPAC Name: 4-[4-(furan-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-N-prop-2-enylbutanamide Traditional Name: N-allyl-4-[[4-(2-furyl)-6-(trifluoromethyl)pyrimidin-2-yl]thio]butyramide Formula: C16H16F3N3O2S MolecularWeight: 371.37735

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)CCCSC1=NC(=CC(=N1)C(F)(F)F)C2=CC=CO2

Isomeric SMILES

C=CCNC(=O)CCCSC1=NC(=CC(=N1)C(F)(F)F)C2=CC=CO2

InChI

InChI=1S/C16H16F3N3O2S/c1-2-7-20-14(23)6-4-9-25-15-21-11(12-5-3-8-24-12)10-13(22-15)16(17,18)19/h2-3,5,8,10H,1,4,6-7,9H2,(H,20,23)