1-(5-chloranyl-1-benzofuran-2-yl)-2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]ethanone

Systemtic Name: 1-(5-chloranyl-1-benzofuran-2-yl)-2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]ethanone Openeye Name: 1-(5-chlorobenzofuran-2-yl)-2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]ethanone CAS Name: 1-(5-chloro-2-benzofuranyl)-2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)thio]ethanone IUPAC Name: 1-(5-chloro-1-benzofuran-2-yl)-2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]ethanone Traditional Name: 1-(5-chlorobenzofuran-2-yl)-2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)thio]ethanone Formula: C18H16ClN3O2S MolecularWeight: 373.85654

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NN=C(N2C3CC3)SCC(=O)C4=CC5=C(O4)C=CC(=C5)Cl

Isomeric SMILES

C1CC1C2=NN=C(N2C3CC3)SCC(=O)C4=CC5=C(O4)C=CC(=C5)Cl

InChI

InChI=1S/C18H16ClN3O2S/c19-12-3-6-15-11(7-12)8-16(24-15)14(23)9-25-18-21-20-17(10-1-2-10)22(18)13-4-5-13/h3,6-8,10,13H,1-2,4-5,9H2