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

Systemtic Name: 3-[(E)-but-2-enyl]sulfanyl-4-phenethyl-1H-1,2,4-triazol-5-one Openeye Name: 3-[(E)-but-2-enyl]sulfanyl-4-phenethyl-1H-1,2,4-triazol-5-one CAS Name: 3-[[(E)-but-2-enyl]thio]-4-phenethyl-1H-1,2,4-triazol-5-one IUPAC Name: 3-[(E)-but-2-enyl]sulfanyl-4-phenethyl-1H-1,2,4-triazol-5-one Traditional Name: 3-[[(E)-but-2-enyl]thio]-4-phenethyl-1H-1,2,4-triazol-5-one Formula: C14H17N3OS MolecularWeight: 275.36928

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C/C=C/CSC1=NNC(=O)N1CCC2=CC=CC=C2

InChI

InChI=1S/C14H17N3OS/c1-2-3-11-19-14-16-15-13(18)17(14)10-9-12-7-5-4-6-8-12/h2-8H,9-11H2,1H3,(H,15,18)/b3-2+