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

Systemtic Name: 3-cyclopropyl-2-[(5-phenyl-1,2-oxazol-3-yl)methylsulfanyl]quinazolin-4-one Openeye Name: 3-cyclopropyl-2-[(5-phenylisoxazol-3-yl)methylsulfanyl]quinazolin-4-one CAS Name: 3-cyclopropyl-2-[(5-phenyl-3-isoxazolyl)methylthio]-4-quinazolinone IUPAC Name: 3-cyclopropyl-2-[(5-phenyl-1,2-oxazol-3-yl)methylsulfanyl]quinazolin-4-one Traditional Name: 3-cyclopropyl-2-[(5-phenylisoxazol-3-yl)methylthio]quinazolin-4-one Formula: C21H17N3O2S MolecularWeight: 375.44358

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=O)C3=CC=CC=C3N=C2SCC4=NOC(=C4)C5=CC=CC=C5

Isomeric SMILES

C1CC1N2C(=O)C3=CC=CC=C3N=C2SCC4=NOC(=C4)C5=CC=CC=C5

InChI

InChI=1S/C21H17N3O2S/c25-20-17-8-4-5-9-18(17)22-21(24(20)16-10-11-16)27-13-15-12-19(26-23-15)14-6-2-1-3-7-14/h1-9,12,16H,10-11,13H2