methyl 3-[(4-chlorophenyl)methyl]-4-oxidanylidene-2-[2-oxidanylidene-2-(2-oxidanylidenechromen-3-yl)ethyl]sulfanyl-quinazoline-7-carboxylate

Systemtic Name: methyl 3-[(4-chlorophenyl)methyl]-4-oxidanylidene-2-[2-oxidanylidene-2-(2-oxidanylidenechromen-3-yl)ethyl]sulfanyl-quinazoline-7-carboxylate Openeye Name: methyl 3-[(4-chlorophenyl)methyl]-4-oxo-2-[2-oxo-2-(2-oxochromen-3-yl)ethyl]sulfanyl-quinazoline-7-carboxylate CAS Name: 3-[(4-chlorophenyl)methyl]-4-oxo-2-[[2-oxo-2-(2-oxo-1-benzopyran-3-yl)ethyl]thio]-7-quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 3-[(4-chlorophenyl)methyl]-4-oxo-2-[2-oxo-2-(2-oxochromen-3-yl)ethyl]sulfanylquinazoline-7-carboxylate Traditional Name: 3-(4-chlorobenzyl)-4-keto-2-[[2-keto-2-(2-ketochromen-3-yl)ethyl]thio]quinazoline-7-carboxylic acid methyl ester Formula: C28H19ClN2O6S MolecularWeight: 546.97826

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C(=O)N(C(=N2)SCC(=O)C3=CC4=CC=CC=C4OC3=O)CC5=CC=C(C=C5)Cl

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=O)N(C(=N2)SCC(=O)C3=CC4=CC=CC=C4OC3=O)CC5=CC=C(C=C5)Cl

InChI

InChI=1S/C28H19ClN2O6S/c1-36-26(34)18-8-11-20-22(13-18)30-28(31(25(20)33)14-16-6-9-19(29)10-7-16)38-15-23(32)21-12-17-4-2-3-5-24(17)37-27(21)35/h2-13H,14-15H2,1H3