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

Systemtic Name: 2-[(5-ethyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-1-(3-methoxyphenyl)ethanone Openeye Name: 2-[(5-ethyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-1-(3-methoxyphenyl)ethanone CAS Name: 2-[(5-ethyl-4-phenyl-1,2,4-triazol-3-yl)thio]-1-(3-methoxyphenyl)ethanone IUPAC Name: 2-[(5-ethyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-1-(3-methoxyphenyl)ethanone Traditional Name: 2-[(5-ethyl-4-phenyl-1,2,4-triazol-3-yl)thio]-1-(3-methoxyphenyl)ethanone Formula: C19H19N3O2S MolecularWeight: 353.43806

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(N1C2=CC=CC=C2)SCC(=O)C3=CC(=CC=C3)OC

Isomeric SMILES

CCC1=NN=C(N1C2=CC=CC=C2)SCC(=O)C3=CC(=CC=C3)OC

InChI

InChI=1S/C19H19N3O2S/c1-3-18-20-21-19(22(18)15-9-5-4-6-10-15)25-13-17(23)14-8-7-11-16(12-14)24-2/h4-12H,3,13H2,1-2H3