3-(5-methylpyridin-2-yl)-2-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methylsulfanyl]quinazolin-4-one

Systemtic Name: 3-(5-methylpyridin-2-yl)-2-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methylsulfanyl]quinazolin-4-one Openeye Name: 3-(5-methyl-2-pyridyl)-2-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methylsulfanyl]quinazolin-4-one CAS Name: 3-(5-methyl-2-pyridinyl)-2-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methylthio]-4-quinazolinone IUPAC Name: 3-(5-methylpyridin-2-yl)-2-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methylsulfanyl]quinazolin-4-one Traditional Name: 3-(5-methyl-2-pyridyl)-2-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methylthio]quinazolin-4-one Formula: C23H16N6O4S MolecularWeight: 472.47594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=NN=C(O4)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

CC1=CN=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=NN=C(O4)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C23H16N6O4S/c1-14-6-11-19(24-12-14)28-22(30)17-4-2-3-5-18(17)25-23(28)34-13-20-26-27-21(33-20)15-7-9-16(10-8-15)29(31)32/h2-12H,13H2,1H3