3-(3,5-dimethylphenyl)-2-[(3-methoxyphenyl)methylsulfanyl]-7-morpholin-4-ylcarbonyl-quinazolin-4-one

Systemtic Name: 3-(3,5-dimethylphenyl)-2-[(3-methoxyphenyl)methylsulfanyl]-7-morpholin-4-ylcarbonyl-quinazolin-4-one Openeye Name: 3-(3,5-dimethylphenyl)-2-[(3-methoxyphenyl)methylsulfanyl]-7-(morpholine-4-carbonyl)quinazolin-4-one CAS Name: 3-(3,5-dimethylphenyl)-2-[(3-methoxyphenyl)methylthio]-7-[4-morpholinyl(oxo)methyl]-4-quinazolinone IUPAC Name: 3-(3,5-dimethylphenyl)-2-[(3-methoxyphenyl)methylsulfanyl]-7-(morpholine-4-carbonyl)quinazolin-4-one Traditional Name: 3-(3,5-dimethylphenyl)-2-(m-anisylthio)-7-(morpholine-4-carbonyl)quinazolin-4-one Formula: C29H29N3O4S MolecularWeight: 515.62326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2C(=O)C3=C(C=C(C=C3)C(=O)N4CCOCC4)N=C2SCC5=CC(=CC=C5)OC)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2C(=O)C3=C(C=C(C=C3)C(=O)N4CCOCC4)N=C2SCC5=CC(=CC=C5)OC)C

InChI

InChI=1S/C29H29N3O4S/c1-19-13-20(2)15-23(14-19)32-28(34)25-8-7-22(27(33)31-9-11-36-12-10-31)17-26(25)30-29(32)37-18-21-5-4-6-24(16-21)35-3/h4-8,13-17H,9-12,18H2,1-3H3