4-phenethyl-3-[(E)-3-phenylprop-2-enyl]sulfanyl-1H-1,2,4-triazol-5-one

Systemtic Name: 4-phenethyl-3-[(E)-3-phenylprop-2-enyl]sulfanyl-1H-1,2,4-triazol-5-one Openeye Name: 3-[(E)-cinnamyl]sulfanyl-4-phenethyl-1H-1,2,4-triazol-5-one CAS Name: 4-phenethyl-3-[[(E)-3-phenylprop-2-enyl]thio]-1H-1,2,4-triazol-5-one IUPAC Name: 4-phenethyl-3-[(E)-3-phenylprop-2-enyl]sulfanyl-1H-1,2,4-triazol-5-one Traditional Name: 3-[[(E)-cinnamyl]thio]-4-phenethyl-1H-1,2,4-triazol-5-one Formula: C19H19N3OS MolecularWeight: 337.43866

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C(=O)NN=C2SCC=CC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CCN2C(=O)NN=C2SC/C=C/C3=CC=CC=C3

InChI

InChI=1S/C19H19N3OS/c23-18-20-21-19(22(18)14-13-17-10-5-2-6-11-17)24-15-7-12-16-8-3-1-4-9-16/h1-12H,13-15H2,(H,20,23)/b12-7+