7-chloranyl-2-[(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]-3-propyl-quinazolin-4-one

Systemtic Name: 7-chloranyl-2-[(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]-3-propyl-quinazolin-4-one Openeye Name: 7-chloro-2-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methylsulfanyl]-3-propyl-quinazolin-4-one CAS Name: 7-chloro-2-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methylthio]-3-propyl-4-quinazolinone IUPAC Name: 7-chloro-2-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methylsulfanyl]-3-propylquinazolin-4-one Traditional Name: 7-chloro-2-[(7-chloro-4-keto-1H-quinazolin-2-yl)methylthio]-3-propyl-quinazolin-4-one Formula: C20H16Cl2N4O2S MolecularWeight: 447.33764

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC3=NC(=O)C4=C(N3)C=C(C=C4)Cl

Isomeric SMILES

CCCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC3=NC(=O)C4=C(N3)C=C(C=C4)Cl

InChI

InChI=1S/C20H16Cl2N4O2S/c1-2-7-26-19(28)14-6-4-12(22)9-16(14)24-20(26)29-10-17-23-15-8-11(21)3-5-13(15)18(27)25-17/h3-6,8-9H,2,7,10H2,1H3,(H,23,25,27)