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

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

CCCCC1=NOC(=N1)CSC2=NC3=CC=CC=C3C(=O)N2C4=NC=CC(=C4)C

Isomeric SMILES

CCCCC1=NOC(=N1)CSC2=NC3=CC=CC=C3C(=O)N2C4=NC=CC(=C4)C

InChI

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