ethyl 8-[[3-(2,2-diethoxyethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylmethyl]-4H-1,3-benzodioxine-6-carboxylate

Systemtic Name: ethyl 8-[[3-(2,2-diethoxyethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylmethyl]-4H-1,3-benzodioxine-6-carboxylate Openeye Name: ethyl 8-[[3-(2,2-diethoxyethyl)-4-oxo-quinazolin-2-yl]sulfanylmethyl]-4H-1,3-benzodioxine-6-carboxylate CAS Name: 8-[[[3-(2,2-diethoxyethyl)-4-oxo-2-quinazolinyl]thio]methyl]-4H-1,3-benzodioxin-6-carboxylic acid ethyl ester IUPAC Name: ethyl 8-[[3-(2,2-diethoxyethyl)-4-oxoquinazolin-2-yl]sulfanylmethyl]-4H-1,3-benzodioxine-6-carboxylate Traditional Name: 8-[[[3-(2,2-diethoxyethyl)-4-keto-quinazolin-2-yl]thio]methyl]-4H-1,3-benzodioxin-6-carboxylic acid ethyl ester Formula: C26H30N2O7S MolecularWeight: 514.5906

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CN1C(=O)C2=CC=CC=C2N=C1SCC3=CC(=CC4=C3OCOC4)C(=O)OCC)OCC

Isomeric SMILES

CCOC(CN1C(=O)C2=CC=CC=C2N=C1SCC3=CC(=CC4=C3OCOC4)C(=O)OCC)OCC

InChI

InChI=1S/C26H30N2O7S/c1-4-32-22(33-5-2)13-28-24(29)20-9-7-8-10-21(20)27-26(28)36-15-19-12-17(25(30)34-6-3)11-18-14-31-16-35-23(18)19/h7-12,22H,4-6,13-16H2,1-3H3