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

Systemtic Name: 3-(3,5-dimethylphenyl)-2-[(3-methylphenyl)methylsulfanyl]-7-morpholin-4-ylcarbonyl-quinazolin-4-one Openeye Name: 3-(3,5-dimethylphenyl)-7-(morpholine-4-carbonyl)-2-(m-tolylmethylsulfanyl)quinazolin-4-one CAS Name: 3-(3,5-dimethylphenyl)-2-[(3-methylphenyl)methylthio]-7-[4-morpholinyl(oxo)methyl]-4-quinazolinone IUPAC Name: 3-(3,5-dimethylphenyl)-2-[(3-methylphenyl)methylsulfanyl]-7-(morpholine-4-carbonyl)quinazolin-4-one Traditional Name: 3-(3,5-dimethylphenyl)-2-[(3-methylbenzyl)thio]-7-(morpholine-4-carbonyl)quinazolin-4-one Formula: C29H29N3O3S MolecularWeight: 499.62386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CSC2=NC3=C(C=CC(=C3)C(=O)N4CCOCC4)C(=O)N2C5=CC(=CC(=C5)C)C

Isomeric SMILES

CC1=CC(=CC=C1)CSC2=NC3=C(C=CC(=C3)C(=O)N4CCOCC4)C(=O)N2C5=CC(=CC(=C5)C)C

InChI

InChI=1S/C29H29N3O3S/c1-19-5-4-6-22(14-19)18-36-29-30-26-17-23(27(33)31-9-11-35-12-10-31)7-8-25(26)28(34)32(29)24-15-20(2)13-21(3)16-24/h4-8,13-17H,9-12,18H2,1-3H3