2-[(1-tert-butyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-N-(6-ethanoyl-1,3-benzodioxol-5-yl)ethanamide

Systemtic Name: 2-[(1-tert-butyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-N-(6-ethanoyl-1,3-benzodioxol-5-yl)ethanamide Openeye Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(1-tert-butyltetrazol-5-yl)sulfanyl-acetamide CAS Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-[(1-tert-butyl-5-tetrazolyl)thio]acetamide IUPAC Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(1-tert-butyltetrazol-5-yl)sulfanylacetamide Traditional Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-[(1-tert-butyltetrazol-5-yl)thio]acetamide Formula: C16H19N5O4S MolecularWeight: 377.41816

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1NC(=O)CSC3=NN=NN3C(C)(C)C)OCO2

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1NC(=O)CSC3=NN=NN3C(C)(C)C)OCO2

InChI

InChI=1S/C16H19N5O4S/c1-9(22)10-5-12-13(25-8-24-12)6-11(10)17-14(23)7-26-15-18-19-20-21(15)16(2,3)4/h5-6H,7-8H2,1-4H3,(H,17,23)