5-[[4-[2-(5-ethylpyridin-2-yl)ethoxy]phenyl]methyl]-2-oxidanylidene-1,2,3-thiadiazolidin-2-ium-4-one

Systemtic Name: 5-[[4-[2-(5-ethylpyridin-2-yl)ethoxy]phenyl]methyl]-2-oxidanylidene-1,2,3-thiadiazolidin-2-ium-4-one Openeye Name: 5-[[4-[2-(5-ethyl-2-pyridyl)ethoxy]phenyl]methyl]-2-oxo-thiadiazolidin-2-ium-4-one CAS Name: 5-[[4-[2-(5-ethyl-2-pyridinyl)ethoxy]phenyl]methyl]-2-oxo-4-thiadiazolidin-2-iumone IUPAC Name: 5-[[4-[2-(5-ethylpyridin-2-yl)ethoxy]phenyl]methyl]-2-oxothiadiazolidin-2-ium-4-one Traditional Name: 5-[4-[2-(5-ethyl-2-pyridyl)ethoxy]benzyl]-2-keto-thiadiazolidin-2-ium-4-one Formula: C18H20N3O3S+ MolecularWeight: 358.4347

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CN=C(C=C1)CCOC2=CC=C(C=C2)CC3C(=O)N[N+](=O)S3

Isomeric SMILES

CCC1=CN=C(C=C1)CCOC2=CC=C(C=C2)CC3C(=O)N[N+](=O)S3

InChI

InChI=1S/C18H19N3O3S/c1-2-13-3-6-15(19-12-13)9-10-24-16-7-4-14(5-8-16)11-17-18(22)20-21(23)25-17/h3-8,12,17H,2,9-11H2,1H3/p+1