2-[(4-tert-butylphenyl)methylsulfanyl]-3-[(4-methoxyphenyl)methyl]-6-morpholin-4-yl-quinazolin-4-one

Systemtic Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-3-[(4-methoxyphenyl)methyl]-6-morpholin-4-yl-quinazolin-4-one Openeye Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-3-[(4-methoxyphenyl)methyl]-6-morpholino-quinazolin-4-one CAS Name: 2-[(4-tert-butylphenyl)methylthio]-3-[(4-methoxyphenyl)methyl]-6-(4-morpholinyl)-4-quinazolinone IUPAC Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-3-[(4-methoxyphenyl)methyl]-6-morpholin-4-ylquinazolin-4-one Traditional Name: 2-[(4-tert-butylbenzyl)thio]-6-morpholino-3-p-anisyl-quinazolin-4-one Formula: C31H35N3O3S MolecularWeight: 529.6929

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CSC2=NC3=C(C=C(C=C3)N4CCOCC4)C(=O)N2CC5=CC=C(C=C5)OC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CSC2=NC3=C(C=C(C=C3)N4CCOCC4)C(=O)N2CC5=CC=C(C=C5)OC

InChI

InChI=1S/C31H35N3O3S/c1-31(2,3)24-9-5-23(6-10-24)21-38-30-32-28-14-11-25(33-15-17-37-18-16-33)19-27(28)29(35)34(30)20-22-7-12-26(36-4)13-8-22/h5-14,19H,15-18,20-21H2,1-4H3