2-[[1-(1,3-benzodioxol-5-yl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-N-ethyl-N-phenyl-ethanamide

Systemtic Name: 2-[[1-(1,3-benzodioxol-5-yl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-N-ethyl-N-phenyl-ethanamide Openeye Name: 2-[1-(1,3-benzodioxol-5-yl)tetrazol-5-yl]sulfanyl-N-ethyl-N-phenyl-acetamide CAS Name: 2-[[1-(1,3-benzodioxol-5-yl)-5-tetrazolyl]thio]-N-ethyl-N-phenylacetamide IUPAC Name: 2-[1-(1,3-benzodioxol-5-yl)tetrazol-5-yl]sulfanyl-N-ethyl-N-phenylacetamide Traditional Name: 2-[[1-(1,3-benzodioxol-5-yl)tetrazol-5-yl]thio]-N-ethyl-N-phenyl-acetamide Formula: C18H17N5O3S MolecularWeight: 383.42428

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)C(=O)CSC2=NN=NN2C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCN(C1=CC=CC=C1)C(=O)CSC2=NN=NN2C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C18H17N5O3S/c1-2-22(13-6-4-3-5-7-13)17(24)11-27-18-19-20-21-23(18)14-8-9-15-16(10-14)26-12-25-15/h3-10H,2,11-12H2,1H3