methyl 2-[2-[2-(3-chloranyl-4-methoxy-phenyl)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-quinazolin-3-yl]ethanoate

Systemtic Name: methyl 2-[2-[2-(3-chloranyl-4-methoxy-phenyl)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-quinazolin-3-yl]ethanoate Openeye Name: methyl 2-[2-[2-(3-chloro-4-methoxy-phenyl)-2-oxo-ethyl]sulfanyl-4-oxo-quinazolin-3-yl]acetate CAS Name: 2-[2-[[2-(3-chloro-4-methoxyphenyl)-2-oxoethyl]thio]-4-oxo-3-quinazolinyl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[2-(3-chloro-4-methoxyphenyl)-2-oxoethyl]sulfanyl-4-oxoquinazolin-3-yl]acetate Traditional Name: 2-[2-[[2-(3-chloro-4-methoxy-phenyl)-2-keto-ethyl]thio]-4-keto-quinazolin-3-yl]acetic acid methyl ester Formula: C20H17ClN2O5S MolecularWeight: 432.87738

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC(=O)OC)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC(=O)OC)Cl

InChI

InChI=1S/C20H17ClN2O5S/c1-27-17-8-7-12(9-14(17)21)16(24)11-29-20-22-15-6-4-3-5-13(15)19(26)23(20)10-18(25)28-2/h3-9H,10-11H2,1-2H3