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

Systemtic Name: 4-[(4-chlorophenyl)methylsulfanyl]-2-[(6-ethyl-4-methyl-quinazolin-2-yl)amino]-1H-pyrimidin-6-one Openeye Name: 4-[(4-chlorophenyl)methylsulfanyl]-2-[(6-ethyl-4-methyl-quinazolin-2-yl)amino]-1H-pyrimidin-6-one CAS Name: 4-[(4-chlorophenyl)methylthio]-2-[(6-ethyl-4-methyl-2-quinazolinyl)amino]-1H-pyrimidin-6-one IUPAC Name: 4-[(4-chlorophenyl)methylsulfanyl]-2-[(6-ethyl-4-methylquinazolin-2-yl)amino]-1H-pyrimidin-6-one Traditional Name: 4-[(4-chlorobenzyl)thio]-2-[(6-ethyl-4-methyl-quinazolin-2-yl)amino]-1H-pyrimidin-6-one Formula: C22H20ClN5OS MolecularWeight: 437.9451

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(N=C2C)NC3=NC(=CC(=O)N3)SCC4=CC=C(C=C4)Cl

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(N=C2C)NC3=NC(=CC(=O)N3)SCC4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H20ClN5OS/c1-3-14-6-9-18-17(10-14)13(2)24-21(25-18)28-22-26-19(29)11-20(27-22)30-12-15-4-7-16(23)8-5-15/h4-11H,3,12H2,1-2H3,(H2,24,25,26,27,28,29)