1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(4-methyl-5-naphthalen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone

Systemtic Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(4-methyl-5-naphthalen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone Openeye Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[[4-methyl-5-(2-naphthyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone CAS Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[[4-methyl-5-(2-naphthalenyl)-1,2,4-triazol-3-yl]thio]ethanone IUPAC Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(4-methyl-5-naphthalen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone Traditional Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[[4-methyl-5-(2-naphthyl)-1,2,4-triazol-3-yl]thio]ethanone Formula: C23H19N3O3S MolecularWeight: 417.48026

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC(=O)C2=CC3=C(C=C2)OCCO3)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

CN1C(=NN=C1SCC(=O)C2=CC3=C(C=C2)OCCO3)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C23H19N3O3S/c1-26-22(18-7-6-15-4-2-3-5-16(15)12-18)24-25-23(26)30-14-19(27)17-8-9-20-21(13-17)29-11-10-28-20/h2-9,12-13H,10-11,14H2,1H3