2-[(8-methoxy-4-methyl-quinazolin-2-yl)amino]-4-[(4-methylphenyl)methylsulfanyl]-1H-pyrimidin-6-one

Systemtic Name: 2-[(8-methoxy-4-methyl-quinazolin-2-yl)amino]-4-[(4-methylphenyl)methylsulfanyl]-1H-pyrimidin-6-one Openeye Name: 2-[(8-methoxy-4-methyl-quinazolin-2-yl)amino]-4-(p-tolylmethylsulfanyl)-1H-pyrimidin-6-one CAS Name: 2-[(8-methoxy-4-methyl-2-quinazolinyl)amino]-4-[(4-methylphenyl)methylthio]-1H-pyrimidin-6-one IUPAC Name: 2-[(8-methoxy-4-methylquinazolin-2-yl)amino]-4-[(4-methylphenyl)methylsulfanyl]-1H-pyrimidin-6-one Traditional Name: 2-[(8-methoxy-4-methyl-quinazolin-2-yl)amino]-4-[(4-methylbenzyl)thio]-1H-pyrimidin-6-one Formula: C22H21N5O2S MolecularWeight: 419.49944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=CC(=O)NC(=N2)NC3=NC4=C(C=CC=C4OC)C(=N3)C

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=CC(=O)NC(=N2)NC3=NC4=C(C=CC=C4OC)C(=N3)C

InChI

InChI=1S/C22H21N5O2S/c1-13-7-9-15(10-8-13)12-30-19-11-18(28)24-22(25-19)27-21-23-14(2)16-5-4-6-17(29-3)20(16)26-21/h4-11H,12H2,1-3H3,(H2,23,24,25,26,27,28)