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

Systemtic Name: 3-butyl-2-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methylsulfanyl]quinazolin-4-one Openeye Name: 3-butyl-2-[[5-(2-thienyl)isoxazol-3-yl]methylsulfanyl]quinazolin-4-one CAS Name: 3-butyl-2-[(5-thiophen-2-yl-3-isoxazolyl)methylthio]-4-quinazolinone IUPAC Name: 3-butyl-2-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methylsulfanyl]quinazolin-4-one Traditional Name: 3-butyl-2-[[5-(2-thienyl)isoxazol-3-yl]methylthio]quinazolin-4-one Formula: C20H19N3O2S2 MolecularWeight: 397.51376

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC3=NOC(=C3)C4=CC=CS4

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC3=NOC(=C3)C4=CC=CS4

InChI

InChI=1S/C20H19N3O2S2/c1-2-3-10-23-19(24)15-7-4-5-8-16(15)21-20(23)27-13-14-12-17(25-22-14)18-9-6-11-26-18/h4-9,11-12H,2-3,10,13H2,1H3