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

Systemtic Name: (E)-N-[1-[4-(4-methylphenyl)-5-[(2-methylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]ethyl]-3-phenyl-prop-2-enamide Openeye Name: (E)-N-[1-[5-(o-tolylmethylsulfanyl)-4-(p-tolyl)-1,2,4-triazol-3-yl]ethyl]-3-phenyl-prop-2-enamide CAS Name: (E)-N-[1-[4-(4-methylphenyl)-5-[(2-methylphenyl)methylthio]-1,2,4-triazol-3-yl]ethyl]-3-phenyl-2-propenamide IUPAC Name: (E)-N-[1-[4-(4-methylphenyl)-5-[(2-methylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]ethyl]-3-phenylprop-2-enamide Traditional Name: (E)-N-[1-[5-[(2-methylbenzyl)thio]-4-(p-tolyl)-1,2,4-triazol-3-yl]ethyl]-3-phenyl-acrylamide Formula: C28H28N4OS MolecularWeight: 468.61312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=CC=C3C)C(C)NC(=O)C=CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=CC=C3C)C(C)NC(=O)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C28H28N4OS/c1-20-13-16-25(17-14-20)32-27(22(3)29-26(33)18-15-23-10-5-4-6-11-23)30-31-28(32)34-19-24-12-8-7-9-21(24)2/h4-18,22H,19H2,1-3H3,(H,29,33)/b18-15+