1-ethyl-4-oxidanylidene-N-(2-sulfanylethyl)-[1,3]dioxolo[4,5-g]cinnoline-3-carboxamide

Systemtic Name: 1-ethyl-4-oxidanylidene-N-(2-sulfanylethyl)-[1,3]dioxolo[4,5-g]cinnoline-3-carboxamide Openeye Name: 1-ethyl-4-oxo-N-(2-sulfanylethyl)-[1,3]dioxolo[4,5-g]cinnoline-3-carboxamide CAS Name: 1-ethyl-N-(2-mercaptoethyl)-4-oxo-[1,3]dioxolo[4,5-g]cinnoline-3-carboxamide IUPAC Name: 1-ethyl-4-oxo-N-(2-sulfanylethyl)-[1,3]dioxolo[4,5-g]cinnoline-3-carboxamide Traditional Name: 1-ethyl-4-keto-N-(2-mercaptoethyl)-[1,3]dioxolo[4,5-g]cinnoline-3-carboxamide Formula: C14H15N3O4S MolecularWeight: 321.3516

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC3=C(C=C2C(=O)C(=N1)C(=O)NCCS)OCO3

Isomeric SMILES

CCN1C2=CC3=C(C=C2C(=O)C(=N1)C(=O)NCCS)OCO3

InChI

InChI=1S/C14H15N3O4S/c1-2-17-9-6-11-10(20-7-21-11)5-8(9)13(18)12(16-17)14(19)15-3-4-22/h5-6,22H,2-4,7H2,1H3,(H,15,19)