methyl 2-[2-[(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]-4-oxidanylidene-quinazolin-3-yl]ethanoate

Systemtic Name: methyl 2-[2-[(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]-4-oxidanylidene-quinazolin-3-yl]ethanoate Openeye Name: methyl 2-[2-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methylsulfanyl]-4-oxo-quinazolin-3-yl]acetate CAS Name: 2-[2-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methylthio]-4-oxo-3-quinazolinyl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methylsulfanyl]-4-oxoquinazolin-3-yl]acetate Traditional Name: 2-[2-[(7-chloro-4-keto-1H-quinazolin-2-yl)methylthio]-4-keto-quinazolin-3-yl]acetic acid methyl ester Formula: C20H15ClN4O4S MolecularWeight: 442.8755

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C(=O)C2=CC=CC=C2N=C1SCC3=NC(=O)C4=C(N3)C=C(C=C4)Cl

Isomeric SMILES

COC(=O)CN1C(=O)C2=CC=CC=C2N=C1SCC3=NC(=O)C4=C(N3)C=C(C=C4)Cl

InChI

InChI=1S/C20H15ClN4O4S/c1-29-17(26)9-25-19(28)13-4-2-3-5-14(13)23-20(25)30-10-16-22-15-8-11(21)6-7-12(15)18(27)24-16/h2-8H,9-10H2,1H3,(H,22,24,27)