ethyl 2-[4-oxidanylidene-3-[2-(4-sulfamoylphenyl)ethyl]quinazolin-2-yl]sulfanylethanoate

Systemtic Name: ethyl 2-[4-oxidanylidene-3-[2-(4-sulfamoylphenyl)ethyl]quinazolin-2-yl]sulfanylethanoate Openeye Name: ethyl 2-[4-oxo-3-[2-(4-sulfamoylphenyl)ethyl]quinazolin-2-yl]sulfanylacetate CAS Name: 2-[[4-oxo-3-[2-(4-sulfamoylphenyl)ethyl]-2-quinazolinyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-oxo-3-[2-(4-sulfamoylphenyl)ethyl]quinazolin-2-yl]sulfanylacetate Traditional Name: 2-[[4-keto-3-[2-(4-sulfamoylphenyl)ethyl]quinazolin-2-yl]thio]acetic acid ethyl ester Formula: C20H21N3O5S2 MolecularWeight: 447.52784

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NC2=CC=CC=C2C(=O)N1CCC3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

CCOC(=O)CSC1=NC2=CC=CC=C2C(=O)N1CCC3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C20H21N3O5S2/c1-2-28-18(24)13-29-20-22-17-6-4-3-5-16(17)19(25)23(20)12-11-14-7-9-15(10-8-14)30(21,26)27/h3-10H,2,11-13H2,1H3,(H2,21,26,27)