2-[(4-chlorophenyl)methylsulfanyl]-6-morpholin-4-yl-3-phenethyl-quinazolin-4-one

Systemtic Name: 2-[(4-chlorophenyl)methylsulfanyl]-6-morpholin-4-yl-3-phenethyl-quinazolin-4-one Openeye Name: 2-[(4-chlorophenyl)methylsulfanyl]-6-morpholino-3-phenethyl-quinazolin-4-one CAS Name: 2-[(4-chlorophenyl)methylthio]-6-(4-morpholinyl)-3-phenethyl-4-quinazolinone IUPAC Name: 2-[(4-chlorophenyl)methylsulfanyl]-6-morpholin-4-yl-3-phenethylquinazolin-4-one Traditional Name: 2-[(4-chlorobenzyl)thio]-6-morpholino-3-phenethyl-quinazolin-4-one Formula: C27H26ClN3O2S MolecularWeight: 492.03224

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC3=C(C=C2)N=C(N(C3=O)CCC4=CC=CC=C4)SCC5=CC=C(C=C5)Cl

Isomeric SMILES

C1COCCN1C2=CC3=C(C=C2)N=C(N(C3=O)CCC4=CC=CC=C4)SCC5=CC=C(C=C5)Cl

InChI

InChI=1S/C27H26ClN3O2S/c28-22-8-6-21(7-9-22)19-34-27-29-25-11-10-23(30-14-16-33-17-15-30)18-24(25)26(32)31(27)13-12-20-4-2-1-3-5-20/h1-11,18H,12-17,19H2