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

Systemtic Name: 2-[(3-chlorophenyl)methylsulfanyl]-7-morpholin-4-ylcarbonyl-3-pentyl-quinazolin-4-one Openeye Name: 2-[(3-chlorophenyl)methylsulfanyl]-7-(morpholine-4-carbonyl)-3-pentyl-quinazolin-4-one CAS Name: 2-[(3-chlorophenyl)methylthio]-7-[4-morpholinyl(oxo)methyl]-3-pentyl-4-quinazolinone IUPAC Name: 2-[(3-chlorophenyl)methylsulfanyl]-7-(morpholine-4-carbonyl)-3-pentylquinazolin-4-one Traditional Name: 3-amyl-2-[(3-chlorobenzyl)thio]-7-(morpholine-4-carbonyl)quinazolin-4-one Formula: C25H28ClN3O3S MolecularWeight: 486.02612

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=C(C=C(C=C2)C(=O)N3CCOCC3)N=C1SCC4=CC(=CC=C4)Cl

Isomeric SMILES

CCCCCN1C(=O)C2=C(C=C(C=C2)C(=O)N3CCOCC3)N=C1SCC4=CC(=CC=C4)Cl

InChI

InChI=1S/C25H28ClN3O3S/c1-2-3-4-10-29-24(31)21-9-8-19(23(30)28-11-13-32-14-12-28)16-22(21)27-25(29)33-17-18-6-5-7-20(26)15-18/h5-9,15-16H,2-4,10-14,17H2,1H3