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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=NC(=NO4)CC(C)C

Isomeric SMILES

CC1=C(N=CC=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=NC(=NO4)CC(C)C

InChI

InChI=1S/C21H21N5O2S/c1-13(2)11-17-24-18(28-25-17)12-29-21-23-16-9-5-4-8-15(16)20(27)26(21)19-14(3)7-6-10-22-19/h4-10,13H,11-12H2,1-3H3