3-(furan-2-yl)-N-[3-methyl-5-(phenylmethylsulfanyl)-1,2,4-triazol-4-yl]prop-2-enamide

Systemtic Name: 3-(furan-2-yl)-N-[3-methyl-5-(phenylmethylsulfanyl)-1,2,4-triazol-4-yl]prop-2-enamide Openeye Name: N-(3-benzylsulfanyl-5-methyl-1,2,4-triazol-4-yl)-3-(2-furyl)prop-2-enamide CAS Name: 3-(2-furanyl)-N-[3-methyl-5-(phenylmethylthio)-1,2,4-triazol-4-yl]-2-propenamide IUPAC Name: N-(3-benzylsulfanyl-5-methyl-1,2,4-triazol-4-yl)-3-(furan-2-yl)prop-2-enamide Traditional Name: N-[3-(benzylthio)-5-methyl-1,2,4-triazol-4-yl]-3-(2-furyl)acrylamide Formula: C17H16N4O2S MolecularWeight: 340.39954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1NC(=O)C=CC2=CC=CO2)SCC3=CC=CC=C3

Isomeric SMILES

CC1=NN=C(N1NC(=O)C=CC2=CC=CO2)SCC3=CC=CC=C3

InChI

InChI=1S/C17H16N4O2S/c1-13-18-19-17(24-12-14-6-3-2-4-7-14)21(13)20-16(22)10-9-15-8-5-11-23-15/h2-11H,12H2,1H3,(H,20,22)