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

Systemtic Name: 2-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methylsulfanyl]-3-(2-propan-2-ylphenyl)quinazolin-4-one Openeye Name: 3-(2-isopropylphenyl)-2-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methylsulfanyl]quinazolin-4-one CAS Name: 2-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methylthio]-3-(2-propan-2-ylphenyl)-4-quinazolinone IUPAC Name: 2-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methylsulfanyl]-3-(2-propan-2-ylphenyl)quinazolin-4-one Traditional Name: 2-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methylthio]-3-o-cumenyl-quinazolin-4-one Formula: C26H21N5O4S MolecularWeight: 499.54104

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2SCC4=NN=C(O4)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2SCC4=NN=C(O4)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C26H21N5O4S/c1-16(2)19-7-4-6-10-22(19)30-25(32)20-8-3-5-9-21(20)27-26(30)36-15-23-28-29-24(35-23)17-11-13-18(14-12-17)31(33)34/h3-14,16H,15H2,1-2H3