3-phenyl-1-[5-(3-phenylprop-2-enylsulfanyl)-1,2,4-triazol-1-yl]prop-2-en-1-one

Systemtic Name: 3-phenyl-1-[5-(3-phenylprop-2-enylsulfanyl)-1,2,4-triazol-1-yl]prop-2-en-1-one Openeye Name: 1-(5-cinnamylsulfanyl-1,2,4-triazol-1-yl)-3-phenyl-prop-2-en-1-one CAS Name: 3-phenyl-1-[5-(3-phenylprop-2-enylthio)-1,2,4-triazol-1-yl]-2-propen-1-one IUPAC Name: 3-phenyl-1-[5-(3-phenylprop-2-enylsulfanyl)-1,2,4-triazol-1-yl]prop-2-en-1-one Traditional Name: 1-[5-(cinnamylthio)-1,2,4-triazol-1-yl]-3-phenyl-prop-2-en-1-one Formula: C20H17N3OS MolecularWeight: 347.43348

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CCSC2=NC=NN2C(=O)C=CC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C=CCSC2=NC=NN2C(=O)C=CC3=CC=CC=C3

InChI

InChI=1S/C20H17N3OS/c24-19(14-13-18-10-5-2-6-11-18)23-20(21-16-22-23)25-15-7-12-17-8-3-1-4-9-17/h1-14,16H,15H2