N-[2-bromanyl-4,6-bis(fluoranyl)phenyl]-2-[[5-(phenoxymethyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-[2-bromanyl-4,6-bis(fluoranyl)phenyl]-2-[[5-(phenoxymethyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: 2-[[4-allyl-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-bromo-4,6-difluoro-phenyl)acetamide CAS Name: N-(2-bromo-4,6-difluorophenyl)-2-[[5-(phenoxymethyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(2-bromo-4,6-difluorophenyl)-2-[[5-(phenoxymethyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: 2-[[4-allyl-5-(phenoxymethyl)-1,2,4-triazol-3-yl]thio]-N-(2-bromo-4,6-difluoro-phenyl)acetamide Formula: C20H17BrF2N4O2S MolecularWeight: 495.340386

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN=C1SCC(=O)NC2=C(C=C(C=C2Br)F)F)COC3=CC=CC=C3

Isomeric SMILES

C=CCN1C(=NN=C1SCC(=O)NC2=C(C=C(C=C2Br)F)F)COC3=CC=CC=C3

InChI

InChI=1S/C20H17BrF2N4O2S/c1-2-8-27-17(11-29-14-6-4-3-5-7-14)25-26-20(27)30-12-18(28)24-19-15(21)9-13(22)10-16(19)23/h2-7,9-10H,1,8,11-12H2,(H,24,28)