2-[(5-ethyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]-1-phenyl-ethanone

Systemtic Name: 2-[(5-ethyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]-1-phenyl-ethanone Openeye Name: 2-[(4-allyl-5-ethyl-1,2,4-triazol-3-yl)sulfanyl]-1-phenyl-ethanone CAS Name: 2-[(5-ethyl-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]-1-phenylethanone IUPAC Name: 2-[(5-ethyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]-1-phenylethanone Traditional Name: 2-[(4-allyl-5-ethyl-1,2,4-triazol-3-yl)thio]-1-phenyl-ethanone Formula: C15H17N3OS MolecularWeight: 287.37998

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(N1CC=C)SCC(=O)C2=CC=CC=C2

Isomeric SMILES

CCC1=NN=C(N1CC=C)SCC(=O)C2=CC=CC=C2

InChI

InChI=1S/C15H17N3OS/c1-3-10-18-14(4-2)16-17-15(18)20-11-13(19)12-8-6-5-7-9-12/h3,5-9H,1,4,10-11H2,2H3