(4-bromanyl-5-cyclopropyl-1,2-oxazol-3-yl)-[2-(phenylsulfanylmethyl)phenyl]methanone

Systemtic Name: (4-bromanyl-5-cyclopropyl-1,2-oxazol-3-yl)-[2-(phenylsulfanylmethyl)phenyl]methanone Openeye Name: (4-bromo-5-cyclopropyl-isoxazol-3-yl)-[2-(phenylsulfanylmethyl)phenyl]methanone CAS Name: (4-bromo-5-cyclopropyl-3-isoxazolyl)-[2-[(phenylthio)methyl]phenyl]methanone IUPAC Name: (4-bromo-5-cyclopropyl-1,2-oxazol-3-yl)-[2-(phenylsulfanylmethyl)phenyl]methanone Traditional Name: (4-bromo-5-cyclopropyl-isoxazol-3-yl)-[2-[(phenylthio)methyl]phenyl]methanone Formula: C20H16BrNO2S MolecularWeight: 414.31554

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=C(C(=NO2)C(=O)C3=CC=CC=C3CSC4=CC=CC=C4)Br

Isomeric SMILES

C1CC1C2=C(C(=NO2)C(=O)C3=CC=CC=C3CSC4=CC=CC=C4)Br

InChI

InChI=1S/C20H16BrNO2S/c21-17-18(22-24-20(17)13-10-11-13)19(23)16-9-5-4-6-14(16)12-25-15-7-2-1-3-8-15/h1-9,13H,10-12H2