2-[(4-methylphenyl)methylsulfanyl]-7-morpholin-4-ylcarbonyl-3-prop-2-enyl-quinazolin-4-one

Systemtic Name: 2-[(4-methylphenyl)methylsulfanyl]-7-morpholin-4-ylcarbonyl-3-prop-2-enyl-quinazolin-4-one Openeye Name: 3-allyl-7-(morpholine-4-carbonyl)-2-(p-tolylmethylsulfanyl)quinazolin-4-one CAS Name: 2-[(4-methylphenyl)methylthio]-7-[4-morpholinyl(oxo)methyl]-3-prop-2-enyl-4-quinazolinone IUPAC Name: 2-[(4-methylphenyl)methylsulfanyl]-7-(morpholine-4-carbonyl)-3-prop-2-enylquinazolin-4-one Traditional Name: 3-allyl-2-[(4-methylbenzyl)thio]-7-(morpholine-4-carbonyl)quinazolin-4-one Formula: C24H25N3O3S MolecularWeight: 435.5386

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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)N2CC=C

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NC3=C(C=CC(=C3)C(=O)N4CCOCC4)C(=O)N2CC=C

InChI

InChI=1S/C24H25N3O3S/c1-3-10-27-23(29)20-9-8-19(22(28)26-11-13-30-14-12-26)15-21(20)25-24(27)31-16-18-6-4-17(2)5-7-18/h3-9,15H,1,10-14,16H2,2H3