2-[(4-chlorophenyl)methylsulfanyl]-3-(4-methoxyphenyl)-7-morpholin-4-ylcarbonyl-quinazolin-4-one

Systemtic Name: 2-[(4-chlorophenyl)methylsulfanyl]-3-(4-methoxyphenyl)-7-morpholin-4-ylcarbonyl-quinazolin-4-one Openeye Name: 2-[(4-chlorophenyl)methylsulfanyl]-3-(4-methoxyphenyl)-7-(morpholine-4-carbonyl)quinazolin-4-one CAS Name: 2-[(4-chlorophenyl)methylthio]-3-(4-methoxyphenyl)-7-[4-morpholinyl(oxo)methyl]-4-quinazolinone IUPAC Name: 2-[(4-chlorophenyl)methylsulfanyl]-3-(4-methoxyphenyl)-7-(morpholine-4-carbonyl)quinazolin-4-one Traditional Name: 2-[(4-chlorobenzyl)thio]-3-(4-methoxyphenyl)-7-(morpholine-4-carbonyl)quinazolin-4-one Formula: C27H24ClN3O4S MolecularWeight: 522.01516

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=O)C3=C(C=C(C=C3)C(=O)N4CCOCC4)N=C2SCC5=CC=C(C=C5)Cl

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=O)C3=C(C=C(C=C3)C(=O)N4CCOCC4)N=C2SCC5=CC=C(C=C5)Cl

InChI

InChI=1S/C27H24ClN3O4S/c1-34-22-9-7-21(8-10-22)31-26(33)23-11-4-19(25(32)30-12-14-35-15-13-30)16-24(23)29-27(31)36-17-18-2-5-20(28)6-3-18/h2-11,16H,12-15,17H2,1H3