ethyl 2-[3-[2-(3,4-dimethoxyphenyl)ethyl]-6-morpholin-4-yl-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoate

Systemtic Name: ethyl 2-[3-[2-(3,4-dimethoxyphenyl)ethyl]-6-morpholin-4-yl-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoate Openeye Name: ethyl 2-[3-[2-(3,4-dimethoxyphenyl)ethyl]-6-morpholino-4-oxo-quinazolin-2-yl]sulfanylacetate CAS Name: 2-[[3-[2-(3,4-dimethoxyphenyl)ethyl]-6-(4-morpholinyl)-4-oxo-2-quinazolinyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[3-[2-(3,4-dimethoxyphenyl)ethyl]-6-morpholin-4-yl-4-oxoquinazolin-2-yl]sulfanylacetate Traditional Name: 2-[(3-homoveratryl-4-keto-6-morpholino-quinazolin-2-yl)thio]acetic acid ethyl ester Formula: C26H31N3O6S MolecularWeight: 513.60584

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H31N3O6S/c1-4-35-24(30)17-36-26-27-21-7-6-19(28-11-13-34-14-12-28)16-20(21)25(31)29(26)10-9-18-5-8-22(32-2)23(15-18)33-3/h5-8,15-16H,4,9-14,17H2,1-3H3