6-morpholin-4-yl-2-phenacylsulfanyl-3-(phenylmethyl)quinazolin-4-one

Systemtic Name: 6-morpholin-4-yl-2-phenacylsulfanyl-3-(phenylmethyl)quinazolin-4-one Openeye Name: 3-benzyl-6-morpholino-2-phenacylsulfanyl-quinazolin-4-one CAS Name: 6-(4-morpholinyl)-2-(phenacylthio)-3-(phenylmethyl)-4-quinazolinone IUPAC Name: 3-benzyl-6-morpholin-4-yl-2-phenacylsulfanylquinazolin-4-one Traditional Name: 3-benzyl-6-morpholino-2-(phenacylthio)quinazolin-4-one Formula: C27H25N3O3S MolecularWeight: 471.5707

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC3=C(C=C2)N=C(N(C3=O)CC4=CC=CC=C4)SCC(=O)C5=CC=CC=C5

Isomeric SMILES

C1COCCN1C2=CC3=C(C=C2)N=C(N(C3=O)CC4=CC=CC=C4)SCC(=O)C5=CC=CC=C5

InChI

InChI=1S/C27H25N3O3S/c31-25(21-9-5-2-6-10-21)19-34-27-28-24-12-11-22(29-13-15-33-16-14-29)17-23(24)26(32)30(27)18-20-7-3-1-4-8-20/h1-12,17H,13-16,18-19H2