(E)-N-[4-[5-[(2-fluorophenyl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]phenyl]-3-phenyl-prop-2-enamide

Systemtic Name: (E)-N-[4-[5-[(2-fluorophenyl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]phenyl]-3-phenyl-prop-2-enamide Openeye Name: (E)-N-[4-[5-[(2-fluorophenyl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]phenyl]-3-phenyl-prop-2-enamide CAS Name: (E)-N-[4-[5-[(2-fluorophenyl)methylthio]-4-methyl-1,2,4-triazol-3-yl]phenyl]-3-phenyl-2-propenamide IUPAC Name: (E)-N-[4-[5-[(2-fluorophenyl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]phenyl]-3-phenylprop-2-enamide Traditional Name: (E)-N-[4-[5-[(2-fluorobenzyl)thio]-4-methyl-1,2,4-triazol-3-yl]phenyl]-3-phenyl-acrylamide Formula: C25H21FN4OS MolecularWeight: 444.523843

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=CC=CC=C2F)C3=CC=C(C=C3)NC(=O)C=CC4=CC=CC=C4

Isomeric SMILES

CN1C(=NN=C1SCC2=CC=CC=C2F)C3=CC=C(C=C3)NC(=O)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C25H21FN4OS/c1-30-24(28-29-25(30)32-17-20-9-5-6-10-22(20)26)19-12-14-21(15-13-19)27-23(31)16-11-18-7-3-2-4-8-18/h2-16H,17H2,1H3,(H,27,31)/b16-11+