7-morpholin-4-ylcarbonyl-2-phenacylsulfanyl-3-(phenylmethyl)quinazolin-4-one

Systemtic Name: 7-morpholin-4-ylcarbonyl-2-phenacylsulfanyl-3-(phenylmethyl)quinazolin-4-one Openeye Name: 3-benzyl-7-(morpholine-4-carbonyl)-2-phenacylsulfanyl-quinazolin-4-one CAS Name: 7-[4-morpholinyl(oxo)methyl]-2-(phenacylthio)-3-(phenylmethyl)-4-quinazolinone IUPAC Name: 3-benzyl-7-(morpholine-4-carbonyl)-2-phenacylsulfanylquinazolin-4-one Traditional Name: 3-benzyl-7-(morpholine-4-carbonyl)-2-(phenacylthio)quinazolin-4-one Formula: C28H25N3O4S MolecularWeight: 499.5808

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H25N3O4S/c32-25(21-9-5-2-6-10-21)19-36-28-29-24-17-22(26(33)30-13-15-35-16-14-30)11-12-23(24)27(34)31(28)18-20-7-3-1-4-8-20/h1-12,17H,13-16,18-19H2