N-(6-ethanoyl-1,3-benzodioxol-5-yl)-2-(5-oxidanylidene-4-thiophen-2-yl-1,2,3,4-tetrazol-1-yl)ethanamide

Systemtic Name: N-(6-ethanoyl-1,3-benzodioxol-5-yl)-2-(5-oxidanylidene-4-thiophen-2-yl-1,2,3,4-tetrazol-1-yl)ethanamide Openeye Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-[5-oxo-4-(2-thienyl)tetrazol-1-yl]acetamide CAS Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(5-oxo-4-thiophen-2-yl-1-tetrazolyl)acetamide IUPAC Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(5-oxo-4-thiophen-2-yltetrazol-1-yl)acetamide Traditional Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-[5-keto-4-(2-thienyl)tetrazol-1-yl]acetamide Formula: C16H13N5O5S MolecularWeight: 387.36992

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1NC(=O)CN3C(=O)N(N=N3)C4=CC=CS4)OCO2

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1NC(=O)CN3C(=O)N(N=N3)C4=CC=CS4)OCO2

InChI

InChI=1S/C16H13N5O5S/c1-9(22)10-5-12-13(26-8-25-12)6-11(10)17-14(23)7-20-16(24)21(19-18-20)15-3-2-4-27-15/h2-6H,7-8H2,1H3,(H,17,23)