(4-ethoxyphenyl) 2-[3-(2-methoxyethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoate

Systemtic Name: (4-ethoxyphenyl) 2-[3-(2-methoxyethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoate Openeye Name: (4-ethoxyphenyl) 2-[3-(2-methoxyethyl)-4-oxo-quinazolin-2-yl]sulfanylacetate CAS Name: 2-[[3-(2-methoxyethyl)-4-oxo-2-quinazolinyl]thio]acetic acid (4-ethoxyphenyl) ester IUPAC Name: (4-ethoxyphenyl) 2-[3-(2-methoxyethyl)-4-oxoquinazolin-2-yl]sulfanylacetate Traditional Name: 2-[[4-keto-3-(2-methoxyethyl)quinazolin-2-yl]thio]acetic acid p-phenetyl ester Formula: C21H22N2O5S MolecularWeight: 414.47478

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CCOC

Isomeric SMILES

CCOC1=CC=C(C=C1)OC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CCOC

InChI

InChI=1S/C21H22N2O5S/c1-3-27-15-8-10-16(11-9-15)28-19(24)14-29-21-22-18-7-5-4-6-17(18)20(25)23(21)12-13-26-2/h4-11H,3,12-14H2,1-2H3