methyl 2-[2-[(4,5-dimethoxy-2-methyl-phenyl)methylsulfanyl]-4-oxidanylidene-quinazolin-3-yl]ethanoate

Systemtic Name: methyl 2-[2-[(4,5-dimethoxy-2-methyl-phenyl)methylsulfanyl]-4-oxidanylidene-quinazolin-3-yl]ethanoate Openeye Name: methyl 2-[2-[(4,5-dimethoxy-2-methyl-phenyl)methylsulfanyl]-4-oxo-quinazolin-3-yl]acetate CAS Name: 2-[2-[(4,5-dimethoxy-2-methylphenyl)methylthio]-4-oxo-3-quinazolinyl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[(4,5-dimethoxy-2-methylphenyl)methylsulfanyl]-4-oxoquinazolin-3-yl]acetate Traditional Name: 2-[2-[(4,5-dimethoxy-2-methyl-benzyl)thio]-4-keto-quinazolin-3-yl]acetic acid methyl ester Formula: C21H22N2O5S MolecularWeight: 414.47478

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1CSC2=NC3=CC=CC=C3C(=O)N2CC(=O)OC)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1CSC2=NC3=CC=CC=C3C(=O)N2CC(=O)OC)OC)OC

InChI

InChI=1S/C21H22N2O5S/c1-13-9-17(26-2)18(27-3)10-14(13)12-29-21-22-16-8-6-5-7-15(16)20(25)23(21)11-19(24)28-4/h5-10H,11-12H2,1-4H3