2-[[4-(4-chlorophenyl)carbonylphenyl]methylsulfanyl]-3-ethyl-5-methyl-quinazolin-4-one

Systemtic Name: 2-[[4-(4-chlorophenyl)carbonylphenyl]methylsulfanyl]-3-ethyl-5-methyl-quinazolin-4-one Openeye Name: 2-[[4-(4-chlorobenzoyl)phenyl]methylsulfanyl]-3-ethyl-5-methyl-quinazolin-4-one CAS Name: 2-[[4-[(4-chlorophenyl)-oxomethyl]phenyl]methylthio]-3-ethyl-5-methyl-4-quinazolinone IUPAC Name: 2-[[4-(4-chlorobenzoyl)phenyl]methylsulfanyl]-3-ethyl-5-methylquinazolin-4-one Traditional Name: 2-[[4-(4-chlorobenzoyl)benzyl]thio]-3-ethyl-5-methyl-quinazolin-4-one Formula: C25H21ClN2O2S MolecularWeight: 448.96444

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(C=CC=C2N=C1SCC3=CC=C(C=C3)C(=O)C4=CC=C(C=C4)Cl)C

Isomeric SMILES

CCN1C(=O)C2=C(C=CC=C2N=C1SCC3=CC=C(C=C3)C(=O)C4=CC=C(C=C4)Cl)C

InChI

InChI=1S/C25H21ClN2O2S/c1-3-28-24(30)22-16(2)5-4-6-21(22)27-25(28)31-15-17-7-9-18(10-8-17)23(29)19-11-13-20(26)14-12-19/h4-14H,3,15H2,1-2H3