ethyl 2-(6-morpholin-4-yl-4-oxidanylidene-3-phenethyl-quinazolin-2-yl)sulfanylethanoate

Systemtic Name: ethyl 2-(6-morpholin-4-yl-4-oxidanylidene-3-phenethyl-quinazolin-2-yl)sulfanylethanoate Openeye Name: ethyl 2-(6-morpholino-4-oxo-3-phenethyl-quinazolin-2-yl)sulfanylacetate CAS Name: 2-[[6-(4-morpholinyl)-4-oxo-3-phenethyl-2-quinazolinyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-(6-morpholin-4-yl-4-oxo-3-phenethylquinazolin-2-yl)sulfanylacetate Traditional Name: 2-[(4-keto-6-morpholino-3-phenethyl-quinazolin-2-yl)thio]acetic acid ethyl ester Formula: C24H27N3O4S MolecularWeight: 453.55388

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NC2=C(C=C(C=C2)N3CCOCC3)C(=O)N1CCC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)CSC1=NC2=C(C=C(C=C2)N3CCOCC3)C(=O)N1CCC4=CC=CC=C4

InChI

InChI=1S/C24H27N3O4S/c1-2-31-22(28)17-32-24-25-21-9-8-19(26-12-14-30-15-13-26)16-20(21)23(29)27(24)11-10-18-6-4-3-5-7-18/h3-9,16H,2,10-15,17H2,1H3