1-(1,3-benzodioxol-5-yl)-2-[(1-cyclopentyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanone

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-2-[(1-cyclopentyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanone Openeye Name: 1-(1,3-benzodioxol-5-yl)-2-(1-cyclopentyltetrazol-5-yl)sulfanyl-ethanone CAS Name: 1-(1,3-benzodioxol-5-yl)-2-[(1-cyclopentyl-5-tetrazolyl)thio]ethanone IUPAC Name: 1-(1,3-benzodioxol-5-yl)-2-(1-cyclopentyltetrazol-5-yl)sulfanylethanone Traditional Name: 1-(1,3-benzodioxol-5-yl)-2-[(1-cyclopentyltetrazol-5-yl)thio]ethanone Formula: C15H16N4O3S MolecularWeight: 332.37754

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C(=NN=N2)SCC(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CCC(C1)N2C(=NN=N2)SCC(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C15H16N4O3S/c20-12(10-5-6-13-14(7-10)22-9-21-13)8-23-15-16-17-18-19(15)11-3-1-2-4-11/h5-7,11H,1-4,8-9H2