7-chloranyl-2-[(4,5-dimethoxy-2-methyl-phenyl)methylsulfanyl]-3-propyl-quinazolin-4-one

Systemtic Name: 7-chloranyl-2-[(4,5-dimethoxy-2-methyl-phenyl)methylsulfanyl]-3-propyl-quinazolin-4-one Openeye Name: 7-chloro-2-[(4,5-dimethoxy-2-methyl-phenyl)methylsulfanyl]-3-propyl-quinazolin-4-one CAS Name: 7-chloro-2-[(4,5-dimethoxy-2-methylphenyl)methylthio]-3-propyl-4-quinazolinone IUPAC Name: 7-chloro-2-[(4,5-dimethoxy-2-methylphenyl)methylsulfanyl]-3-propylquinazolin-4-one Traditional Name: 7-chloro-2-[(4,5-dimethoxy-2-methyl-benzyl)thio]-3-propyl-quinazolin-4-one Formula: C21H23ClN2O3S MolecularWeight: 418.93692

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC3=CC(=C(C=C3C)OC)OC

Isomeric SMILES

CCCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC3=CC(=C(C=C3C)OC)OC

InChI

InChI=1S/C21H23ClN2O3S/c1-5-8-24-20(25)16-7-6-15(22)11-17(16)23-21(24)28-12-14-10-19(27-4)18(26-3)9-13(14)2/h6-7,9-11H,5,8,12H2,1-4H3