2-[(4-methylphenyl)methylsulfanyl]-3-(4-morpholin-4-ylcarbonylphenyl)quinazolin-4-one

Systemtic Name: 2-[(4-methylphenyl)methylsulfanyl]-3-(4-morpholin-4-ylcarbonylphenyl)quinazolin-4-one Openeye Name: 3-[4-(morpholine-4-carbonyl)phenyl]-2-(p-tolylmethylsulfanyl)quinazolin-4-one CAS Name: 2-[(4-methylphenyl)methylthio]-3-[4-[4-morpholinyl(oxo)methyl]phenyl]-4-quinazolinone IUPAC Name: 2-[(4-methylphenyl)methylsulfanyl]-3-[4-(morpholine-4-carbonyl)phenyl]quinazolin-4-one Traditional Name: 2-[(4-methylbenzyl)thio]-3-[4-(morpholine-4-carbonyl)phenyl]quinazolin-4-one Formula: C27H25N3O3S MolecularWeight: 471.5707

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)C(=O)N5CCOCC5

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)C(=O)N5CCOCC5

InChI

InChI=1S/C27H25N3O3S/c1-19-6-8-20(9-7-19)18-34-27-28-24-5-3-2-4-23(24)26(32)30(27)22-12-10-21(11-13-22)25(31)29-14-16-33-17-15-29/h2-13H,14-18H2,1H3