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

Systemtic Name: 1-(1-benzofuran-2-yl)-2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]ethanone Openeye Name: 1-(benzofuran-2-yl)-2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]ethanone CAS Name: 1-(2-benzofuranyl)-2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)thio]ethanone IUPAC Name: 1-(1-benzofuran-2-yl)-2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]ethanone Traditional Name: 1-(benzofuran-2-yl)-2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)thio]ethanone Formula: C18H17N3O2S MolecularWeight: 339.41148

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NN=C(N2C3CC3)SCC(=O)C4=CC5=CC=CC=C5O4

Isomeric SMILES

C1CC1C2=NN=C(N2C3CC3)SCC(=O)C4=CC5=CC=CC=C5O4

InChI

InChI=1S/C18H17N3O2S/c22-14(16-9-12-3-1-2-4-15(12)23-16)10-24-18-20-19-17(11-5-6-11)21(18)13-7-8-13/h1-4,9,11,13H,5-8,10H2