3,4-dicyclopropyl-5-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methylsulfanyl]-1,2,4-triazole

Systemtic Name: 3,4-dicyclopropyl-5-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methylsulfanyl]-1,2,4-triazole Openeye Name: 3,4-dicyclopropyl-5-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methylsulfanyl]-1,2,4-triazole CAS Name: 3,4-dicyclopropyl-5-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methylthio]-1,2,4-triazole IUPAC Name: 3,4-dicyclopropyl-5-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methylsulfanyl]-1,2,4-triazole Traditional Name: 3,4-dicyclopropyl-5-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methylthio]-1,2,4-triazole Formula: C17H19N3O2S MolecularWeight: 329.41666

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NN=C(N2C3CC3)SCC4COC5=CC=CC=C5O4

Isomeric SMILES

C1CC1C2=NN=C(N2C3CC3)SC[C@@H]4COC5=CC=CC=C5O4

InChI

InChI=1S/C17H19N3O2S/c1-2-4-15-14(3-1)21-9-13(22-15)10-23-17-19-18-16(11-5-6-11)20(17)12-7-8-12/h1-4,11-13H,5-10H2/t13-/m0/s1