6-[2-[(1-cyclopentyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanoyl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[2-[(1-cyclopentyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanoyl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[2-(1-cyclopentyltetrazol-5-yl)sulfanylacetyl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[2-[(1-cyclopentyl-5-tetrazolyl)thio]-1-oxoethyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[2-(1-cyclopentyltetrazol-5-yl)sulfanylacetyl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[2-[(1-cyclopentyltetrazol-5-yl)thio]acetyl]-4H-1,4-benzoxazin-3-one Formula: C16H17N5O3S MolecularWeight: 359.40288

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C(=NN=N2)SCC(=O)C3=CC4=C(C=C3)OCC(=O)N4

Isomeric SMILES

C1CCC(C1)N2C(=NN=N2)SCC(=O)C3=CC4=C(C=C3)OCC(=O)N4

InChI

InChI=1S/C16H17N5O3S/c22-13(10-5-6-14-12(7-10)17-15(23)8-24-14)9-25-16-18-19-20-21(16)11-3-1-2-4-11/h5-7,11H,1-4,8-9H2,(H,17,23)