ethyl 2-[2-[3-(4-chlorophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoylamino]ethanoate

Systemtic Name: ethyl 2-[2-[3-(4-chlorophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoylamino]ethanoate Openeye Name: ethyl 2-[[2-[3-(4-chlorophenyl)-4-oxo-quinazolin-2-yl]sulfanylacetyl]amino]acetate CAS Name: 2-[[2-[[3-(4-chlorophenyl)-4-oxo-2-quinazolinyl]thio]-1-oxoethyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[2-[3-(4-chlorophenyl)-4-oxoquinazolin-2-yl]sulfanylacetyl]amino]acetate Traditional Name: 2-[[2-[[3-(4-chlorophenyl)-4-keto-quinazolin-2-yl]thio]acetyl]amino]acetic acid ethyl ester Formula: C20H18ClN3O4S MolecularWeight: 431.89262

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC(=O)CSC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)Cl

Isomeric SMILES

CCOC(=O)CNC(=O)CSC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H18ClN3O4S/c1-2-28-18(26)11-22-17(25)12-29-20-23-16-6-4-3-5-15(16)19(27)24(20)14-9-7-13(21)8-10-14/h3-10H,2,11-12H2,1H3,(H,22,25)