3-(2-chlorophenyl)-N-[2-[(4-cyanophenyl)methylsulfanyl]phenyl]-5-methyl-1,2-oxazole-4-carboxamide

Systemtic Name: 3-(2-chlorophenyl)-N-[2-[(4-cyanophenyl)methylsulfanyl]phenyl]-5-methyl-1,2-oxazole-4-carboxamide Openeye Name: 3-(2-chlorophenyl)-N-[2-[(4-cyanophenyl)methylsulfanyl]phenyl]-5-methyl-isoxazole-4-carboxamide CAS Name: 3-(2-chlorophenyl)-N-[2-[(4-cyanophenyl)methylthio]phenyl]-5-methyl-4-isoxazolecarboxamide IUPAC Name: 3-(2-chlorophenyl)-N-[2-[(4-cyanophenyl)methylsulfanyl]phenyl]-5-methyl-1,2-oxazole-4-carboxamide Traditional Name: 3-(2-chlorophenyl)-N-[2-[(4-cyanobenzyl)thio]phenyl]-5-methyl-isoxazole-4-carboxamide Formula: C25H18ClN3O2S MolecularWeight: 459.94732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC=CC=C2Cl)C(=O)NC3=CC=CC=C3SCC4=CC=C(C=C4)C#N

Isomeric SMILES

CC1=C(C(=NO1)C2=CC=CC=C2Cl)C(=O)NC3=CC=CC=C3SCC4=CC=C(C=C4)C#N

InChI

InChI=1S/C25H18ClN3O2S/c1-16-23(24(29-31-16)19-6-2-3-7-20(19)26)25(30)28-21-8-4-5-9-22(21)32-15-18-12-10-17(14-27)11-13-18/h2-13H,15H2,1H3,(H,28,30)