3-(2,3-dihydro-1,4-benzodioxin-3-yl)-4-methyl-5-(3-phenoxypropylsulfanyl)-1,2,4-triazole

Systemtic Name: 3-(2,3-dihydro-1,4-benzodioxin-3-yl)-4-methyl-5-(3-phenoxypropylsulfanyl)-1,2,4-triazole Openeye Name: 3-(2,3-dihydro-1,4-benzodioxin-3-yl)-4-methyl-5-(3-phenoxypropylsulfanyl)-1,2,4-triazole CAS Name: 3-(2,3-dihydro-1,4-benzodioxin-3-yl)-4-methyl-5-(3-phenoxypropylthio)-1,2,4-triazole IUPAC Name: 3-(2,3-dihydro-1,4-benzodioxin-3-yl)-4-methyl-5-(3-phenoxypropylsulfanyl)-1,2,4-triazole Traditional Name: 3-(2,3-dihydro-1,4-benzodioxin-3-yl)-4-methyl-5-(3-phenoxypropylthio)-1,2,4-triazole Formula: C20H21N3O3S MolecularWeight: 383.46404

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCCCOC2=CC=CC=C2)C3COC4=CC=CC=C4O3

Isomeric SMILES

CN1C(=NN=C1SCCCOC2=CC=CC=C2)C3COC4=CC=CC=C4O3

InChI

InChI=1S/C20H21N3O3S/c1-23-19(18-14-25-16-10-5-6-11-17(16)26-18)21-22-20(23)27-13-7-12-24-15-8-3-2-4-9-15/h2-6,8-11,18H,7,12-14H2,1H3