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

Systemtic Name: 2-[(4-ethenylphenyl)methylsulfanyl]-3-(3-methoxyphenyl)-7-morpholin-4-ylcarbonyl-quinazolin-4-one Openeye Name: 3-(3-methoxyphenyl)-7-(morpholine-4-carbonyl)-2-[(4-vinylphenyl)methylsulfanyl]quinazolin-4-one CAS Name: 2-[(4-ethenylphenyl)methylthio]-3-(3-methoxyphenyl)-7-[4-morpholinyl(oxo)methyl]-4-quinazolinone IUPAC Name: 2-[(4-ethenylphenyl)methylsulfanyl]-3-(3-methoxyphenyl)-7-(morpholine-4-carbonyl)quinazolin-4-one Traditional Name: 3-(3-methoxyphenyl)-7-(morpholine-4-carbonyl)-2-[(4-vinylbenzyl)thio]quinazolin-4-one Formula: C29H27N3O4S MolecularWeight: 513.60738

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H27N3O4S/c1-3-20-7-9-21(10-8-20)19-37-29-30-26-17-22(27(33)31-13-15-36-16-14-31)11-12-25(26)28(34)32(29)23-5-4-6-24(18-23)35-2/h3-12,17-18H,1,13-16,19H2,2H3