3-(3-morpholin-4-ium-4-ylpropyl)-2-[(5-phenyl-1,3-oxazol-2-yl)methylsulfanyl]quinazolin-4-one

Systemtic Name: 3-(3-morpholin-4-ium-4-ylpropyl)-2-[(5-phenyl-1,3-oxazol-2-yl)methylsulfanyl]quinazolin-4-one Openeye Name: 3-(3-morpholin-4-ium-4-ylpropyl)-2-[(5-phenyloxazol-2-yl)methylsulfanyl]quinazolin-4-one CAS Name: 3-[3-(4-morpholin-4-iumyl)propyl]-2-[(5-phenyl-2-oxazolyl)methylthio]-4-quinazolinone IUPAC Name: 3-(3-morpholin-4-ium-4-ylpropyl)-2-[(5-phenyl-1,3-oxazol-2-yl)methylsulfanyl]quinazolin-4-one Traditional Name: 3-(3-morpholin-4-ium-4-ylpropyl)-2-[(5-phenyloxazol-2-yl)methylthio]quinazolin-4-one Formula: C25H27N4O3S+ MolecularWeight: 463.57188

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCN2C(=O)C3=CC=CC=C3N=C2SCC4=NC=C(O4)C5=CC=CC=C5

Isomeric SMILES

C1COCC[NH+]1CCCN2C(=O)C3=CC=CC=C3N=C2SCC4=NC=C(O4)C5=CC=CC=C5

InChI

InChI=1S/C25H26N4O3S/c30-24-20-9-4-5-10-21(20)27-25(29(24)12-6-11-28-13-15-31-16-14-28)33-18-23-26-17-22(32-23)19-7-2-1-3-8-19/h1-5,7-10,17H,6,11-16,18H2/p+1