4-[(4-chlorophenyl)methylsulfanyl]-2-[(6-ethoxy-4-methyl-quinazolin-2-yl)amino]-1H-pyrimidin-6-one

Systemtic Name: 4-[(4-chlorophenyl)methylsulfanyl]-2-[(6-ethoxy-4-methyl-quinazolin-2-yl)amino]-1H-pyrimidin-6-one Openeye Name: 4-[(4-chlorophenyl)methylsulfanyl]-2-[(6-ethoxy-4-methyl-quinazolin-2-yl)amino]-1H-pyrimidin-6-one CAS Name: 4-[(4-chlorophenyl)methylthio]-2-[(6-ethoxy-4-methyl-2-quinazolinyl)amino]-1H-pyrimidin-6-one IUPAC Name: 4-[(4-chlorophenyl)methylsulfanyl]-2-[(6-ethoxy-4-methylquinazolin-2-yl)amino]-1H-pyrimidin-6-one Traditional Name: 4-[(4-chlorobenzyl)thio]-2-[(6-ethoxy-4-methyl-quinazolin-2-yl)amino]-1H-pyrimidin-6-one Formula: C22H20ClN5O2S MolecularWeight: 453.9445

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(N=C2C)NC3=NC(=CC(=O)N3)SCC4=CC=C(C=C4)Cl

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(N=C2C)NC3=NC(=CC(=O)N3)SCC4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H20ClN5O2S/c1-3-30-16-8-9-18-17(10-16)13(2)24-21(25-18)28-22-26-19(29)11-20(27-22)31-12-14-4-6-15(23)7-5-14/h4-11H,3,12H2,1-2H3,(H2,24,25,26,27,28,29)