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

Systemtic Name: 3-(3,5-dimethylphenyl)-2-[(4-methylphenyl)methylsulfanyl]-7-morpholin-4-ylcarbonyl-quinazolin-4-one Openeye Name: 3-(3,5-dimethylphenyl)-7-(morpholine-4-carbonyl)-2-(p-tolylmethylsulfanyl)quinazolin-4-one CAS Name: 3-(3,5-dimethylphenyl)-2-[(4-methylphenyl)methylthio]-7-[4-morpholinyl(oxo)methyl]-4-quinazolinone IUPAC Name: 3-(3,5-dimethylphenyl)-2-[(4-methylphenyl)methylsulfanyl]-7-(morpholine-4-carbonyl)quinazolin-4-one Traditional Name: 3-(3,5-dimethylphenyl)-2-[(4-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=C(C=C1)CSC2=NC3=C(C=CC(=C3)C(=O)N4CCOCC4)C(=O)N2C5=CC(=CC(=C5)C)C

Isomeric SMILES

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

InChI

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