ethyl 4-[3-(4-morpholin-4-ylcarbonylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-3-oxidanylidene-butanoate

Systemtic Name: ethyl 4-[3-(4-morpholin-4-ylcarbonylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-3-oxidanylidene-butanoate Openeye Name: ethyl 4-[3-[4-(morpholine-4-carbonyl)phenyl]-4-oxo-quinazolin-2-yl]sulfanyl-3-oxo-butanoate CAS Name: 4-[[3-[4-[4-morpholinyl(oxo)methyl]phenyl]-4-oxo-2-quinazolinyl]thio]-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-[3-[4-(morpholine-4-carbonyl)phenyl]-4-oxoquinazolin-2-yl]sulfanyl-3-oxobutanoate Traditional Name: 3-keto-4-[[4-keto-3-[4-(morpholine-4-carbonyl)phenyl]quinazolin-2-yl]thio]butyric acid ethyl ester Formula: C25H25N3O6S MolecularWeight: 495.5475

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=O)CSC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)C(=O)N4CCOCC4

Isomeric SMILES

CCOC(=O)CC(=O)CSC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)C(=O)N4CCOCC4

InChI

InChI=1S/C25H25N3O6S/c1-2-34-22(30)15-19(29)16-35-25-26-21-6-4-3-5-20(21)24(32)28(25)18-9-7-17(8-10-18)23(31)27-11-13-33-14-12-27/h3-10H,2,11-16H2,1H3