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

Systemtic Name: 3-(4-butan-2-ylphenyl)-2-[(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)methylsulfanyl]quinazolin-4-one Openeye Name: 2-[[3-(2-pyridyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-3-(4-sec-butylphenyl)quinazolin-4-one CAS Name: 3-(4-butan-2-ylphenyl)-2-[[3-(2-pyridinyl)-1,2,4-oxadiazol-5-yl]methylthio]-4-quinazolinone IUPAC Name: 3-(4-butan-2-ylphenyl)-2-[(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)methylsulfanyl]quinazolin-4-one Traditional Name: 2-[[3-(2-pyridyl)-1,2,4-oxadiazol-5-yl]methylthio]-3-(4-sec-butylphenyl)quinazolin-4-one Formula: C26H23N5O2S MolecularWeight: 469.55812

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=NC(=NO4)C5=CC=CC=N5

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=NC(=NO4)C5=CC=CC=N5

InChI

InChI=1S/C26H23N5O2S/c1-3-17(2)18-11-13-19(14-12-18)31-25(32)20-8-4-5-9-21(20)28-26(31)34-16-23-29-24(30-33-23)22-10-6-7-15-27-22/h4-15,17H,3,16H2,1-2H3