2-[(3-chlorophenyl)methylsulfanyl]-7-morpholin-4-ylcarbonyl-3-(phenylmethyl)quinazolin-4-one

Systemtic Name: 2-[(3-chlorophenyl)methylsulfanyl]-7-morpholin-4-ylcarbonyl-3-(phenylmethyl)quinazolin-4-one Openeye Name: 3-benzyl-2-[(3-chlorophenyl)methylsulfanyl]-7-(morpholine-4-carbonyl)quinazolin-4-one CAS Name: 2-[(3-chlorophenyl)methylthio]-7-[4-morpholinyl(oxo)methyl]-3-(phenylmethyl)-4-quinazolinone IUPAC Name: 3-benzyl-2-[(3-chlorophenyl)methylsulfanyl]-7-(morpholine-4-carbonyl)quinazolin-4-one Traditional Name: 3-benzyl-2-[(3-chlorobenzyl)thio]-7-(morpholine-4-carbonyl)quinazolin-4-one Formula: C27H24ClN3O3S MolecularWeight: 506.01576

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)C2=CC3=C(C=C2)C(=O)N(C(=N3)SCC4=CC(=CC=C4)Cl)CC5=CC=CC=C5

Isomeric SMILES

C1COCCN1C(=O)C2=CC3=C(C=C2)C(=O)N(C(=N3)SCC4=CC(=CC=C4)Cl)CC5=CC=CC=C5

InChI

InChI=1S/C27H24ClN3O3S/c28-22-8-4-7-20(15-22)18-35-27-29-24-16-21(25(32)30-11-13-34-14-12-30)9-10-23(24)26(33)31(27)17-19-5-2-1-3-6-19/h1-10,15-16H,11-14,17-18H2