3-(3-methylbut-2-enylsulfanyl)-4-phenethyl-1H-1,2,4-triazol-5-one

Systemtic Name: 3-(3-methylbut-2-enylsulfanyl)-4-phenethyl-1H-1,2,4-triazol-5-one Openeye Name: 3-(3-methylbut-2-enylsulfanyl)-4-phenethyl-1H-1,2,4-triazol-5-one CAS Name: 3-(3-methylbut-2-enylthio)-4-phenethyl-1H-1,2,4-triazol-5-one IUPAC Name: 3-(3-methylbut-2-enylsulfanyl)-4-phenethyl-1H-1,2,4-triazol-5-one Traditional Name: 3-(3-methylbut-2-enylthio)-4-phenethyl-1H-1,2,4-triazol-5-one Formula: C15H19N3OS MolecularWeight: 289.39586

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCSC1=NNC(=O)N1CCC2=CC=CC=C2)C

Isomeric SMILES

CC(=CCSC1=NNC(=O)N1CCC2=CC=CC=C2)C

InChI

InChI=1S/C15H19N3OS/c1-12(2)9-11-20-15-17-16-14(19)18(15)10-8-13-6-4-3-5-7-13/h3-7,9H,8,10-11H2,1-2H3,(H,16,19)