N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-N-methyl-2-[[1-(thiophen-2-ylmethyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]ethanamide

Systemtic Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-N-methyl-2-[[1-(thiophen-2-ylmethyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]ethanamide Openeye Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-N-methyl-2-[1-(2-thienylmethyl)tetrazol-5-yl]sulfanyl-acetamide CAS Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-N-methyl-2-[[1-(thiophen-2-ylmethyl)-5-tetrazolyl]thio]acetamide IUPAC Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-N-methyl-2-[1-(thiophen-2-ylmethyl)tetrazol-5-yl]sulfanylacetamide Traditional Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-N-methyl-2-[[1-(2-thenyl)tetrazol-5-yl]thio]acetamide Formula: C18H19N5O3S2 MolecularWeight: 417.50516

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1COC2=CC=CC=C2O1)C(=O)CSC3=NN=NN3CC4=CC=CS4

Isomeric SMILES

CN(C[C@H]1COC2=CC=CC=C2O1)C(=O)CSC3=NN=NN3CC4=CC=CS4

InChI

InChI=1S/C18H19N5O3S2/c1-22(9-13-11-25-15-6-2-3-7-16(15)26-13)17(24)12-28-18-19-20-21-23(18)10-14-5-4-8-27-14/h2-8,13H,9-12H2,1H3/t13-/m0/s1