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

Systemtic Name: (E)-N-[4-[5-[2-[(2-fluorophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]phenyl]-3-phenyl-prop-2-enamide Openeye Name: (E)-N-[4-[5-[2-(2-fluoroanilino)-2-oxo-ethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]phenyl]-3-phenyl-prop-2-enamide CAS Name: (E)-N-[4-[5-[[2-(2-fluoroanilino)-2-oxoethyl]thio]-4-methyl-1,2,4-triazol-3-yl]phenyl]-3-phenyl-2-propenamide IUPAC Name: (E)-N-[4-[5-[2-(2-fluoroanilino)-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]phenyl]-3-phenylprop-2-enamide Traditional Name: (E)-N-[4-[5-[[2-(2-fluoroanilino)-2-keto-ethyl]thio]-4-methyl-1,2,4-triazol-3-yl]phenyl]-3-phenyl-acrylamide Formula: C26H22FN5O2S MolecularWeight: 487.548583

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC(=O)NC2=CC=CC=C2F)C3=CC=C(C=C3)NC(=O)C=CC4=CC=CC=C4

Isomeric SMILES

CN1C(=NN=C1SCC(=O)NC2=CC=CC=C2F)C3=CC=C(C=C3)NC(=O)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C26H22FN5O2S/c1-32-25(30-31-26(32)35-17-24(34)29-22-10-6-5-9-21(22)27)19-12-14-20(15-13-19)28-23(33)16-11-18-7-3-2-4-8-18/h2-16H,17H2,1H3,(H,28,33)(H,29,34)/b16-11+