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

Systemtic Name: 2-[(5-tert-butyl-1,2,4-oxadiazol-3-yl)methylsulfanyl]-3-(4-methylpyridin-2-yl)quinazolin-4-one Openeye Name: 2-[(5-tert-butyl-1,2,4-oxadiazol-3-yl)methylsulfanyl]-3-(4-methyl-2-pyridyl)quinazolin-4-one CAS Name: 2-[(5-tert-butyl-1,2,4-oxadiazol-3-yl)methylthio]-3-(4-methyl-2-pyridinyl)-4-quinazolinone IUPAC Name: 2-[(5-tert-butyl-1,2,4-oxadiazol-3-yl)methylsulfanyl]-3-(4-methylpyridin-2-yl)quinazolin-4-one Traditional Name: 2-[(5-tert-butyl-1,2,4-oxadiazol-3-yl)methylthio]-3-(4-methyl-2-pyridyl)quinazolin-4-one Formula: C21H21N5O2S MolecularWeight: 407.48874

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=NOC(=N4)C(C)(C)C

Isomeric SMILES

CC1=CC(=NC=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=NOC(=N4)C(C)(C)C

InChI

InChI=1S/C21H21N5O2S/c1-13-9-10-22-17(11-13)26-18(27)14-7-5-6-8-15(14)23-20(26)29-12-16-24-19(28-25-16)21(2,3)4/h5-11H,12H2,1-4H3