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

Systemtic Name: 3-phenyl-2-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methylsulfanyl]quinazolin-4-one Openeye Name: 3-phenyl-2-[[5-(2-thienyl)isoxazol-3-yl]methylsulfanyl]quinazolin-4-one CAS Name: 3-phenyl-2-[(5-thiophen-2-yl-3-isoxazolyl)methylthio]-4-quinazolinone IUPAC Name: 3-phenyl-2-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methylsulfanyl]quinazolin-4-one Traditional Name: 3-phenyl-2-[[5-(2-thienyl)isoxazol-3-yl]methylthio]quinazolin-4-one Formula: C22H15N3O2S2 MolecularWeight: 417.5034

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=NOC(=C4)C5=CC=CS5

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=NOC(=C4)C5=CC=CS5

InChI

InChI=1S/C22H15N3O2S2/c26-21-17-9-4-5-10-18(17)23-22(25(21)16-7-2-1-3-8-16)29-14-15-13-19(27-24-15)20-11-6-12-28-20/h1-13H,14H2