N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(1-ethyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(1-ethyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(1-ethyltetrazol-5-yl)sulfanyl-acetamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(1-ethyl-5-tetrazolyl)thio]acetamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(1-ethyltetrazol-5-yl)sulfanylacetamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(1-ethyltetrazol-5-yl)thio]acetamide Formula: C13H15N5O3S MolecularWeight: 321.3549

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=N1)SCC(=O)NC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CCN1C(=NN=N1)SCC(=O)NC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C13H15N5O3S/c1-2-18-13(15-16-17-18)22-8-12(19)14-9-3-4-10-11(7-9)21-6-5-20-10/h3-4,7H,2,5-6,8H2,1H3,(H,14,19)