2-[[4-(6-chloranylpyridin-3-yl)carbonylphenyl]methylsulfanyl]-3-methyl-6-oxidanyl-quinazolin-4-one

Systemtic Name: 2-[[4-(6-chloranylpyridin-3-yl)carbonylphenyl]methylsulfanyl]-3-methyl-6-oxidanyl-quinazolin-4-one Openeye Name: 2-[[4-(6-chloropyridine-3-carbonyl)phenyl]methylsulfanyl]-6-hydroxy-3-methyl-quinazolin-4-one CAS Name: 2-[[4-[(6-chloro-3-pyridinyl)-oxomethyl]phenyl]methylthio]-6-hydroxy-3-methyl-4-quinazolinone IUPAC Name: 2-[[4-(6-chloropyridine-3-carbonyl)phenyl]methylsulfanyl]-6-hydroxy-3-methylquinazolin-4-one Traditional Name: 2-[[4-(6-chloronicotinoyl)benzyl]thio]-6-hydroxy-3-methyl-quinazolin-4-one Formula: C22H16ClN3O3S MolecularWeight: 437.89874

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(C=CC(=C2)O)N=C1SCC3=CC=C(C=C3)C(=O)C4=CN=C(C=C4)Cl

Isomeric SMILES

CN1C(=O)C2=C(C=CC(=C2)O)N=C1SCC3=CC=C(C=C3)C(=O)C4=CN=C(C=C4)Cl

InChI

InChI=1S/C22H16ClN3O3S/c1-26-21(29)17-10-16(27)7-8-18(17)25-22(26)30-12-13-2-4-14(5-3-13)20(28)15-6-9-19(23)24-11-15/h2-11,27H,12H2,1H3