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

Systemtic Name: 4-[(4-chlorophenyl)methylsulfanyl]-2-[(8-methoxy-4-methyl-quinazolin-2-yl)amino]-1H-pyrimidin-6-one Openeye Name: 4-[(4-chlorophenyl)methylsulfanyl]-2-[(8-methoxy-4-methyl-quinazolin-2-yl)amino]-1H-pyrimidin-6-one CAS Name: 4-[(4-chlorophenyl)methylthio]-2-[(8-methoxy-4-methyl-2-quinazolinyl)amino]-1H-pyrimidin-6-one IUPAC Name: 4-[(4-chlorophenyl)methylsulfanyl]-2-[(8-methoxy-4-methylquinazolin-2-yl)amino]-1H-pyrimidin-6-one Traditional Name: 4-[(4-chlorobenzyl)thio]-2-[(8-methoxy-4-methyl-quinazolin-2-yl)amino]-1H-pyrimidin-6-one Formula: C21H18ClN5O2S MolecularWeight: 439.91792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC2=C1C=CC=C2OC)NC3=NC(=CC(=O)N3)SCC4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=NC(=NC2=C1C=CC=C2OC)NC3=NC(=CC(=O)N3)SCC4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H18ClN5O2S/c1-12-15-4-3-5-16(29-2)19(15)26-20(23-12)27-21-24-17(28)10-18(25-21)30-11-13-6-8-14(22)9-7-13/h3-10H,11H2,1-2H3,(H2,23,24,25,26,27,28)