(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl 2-chloranyl-5-methylsulfanyl-benzoate

Systemtic Name: (3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl 2-chloranyl-5-methylsulfanyl-benzoate Openeye Name: (3-isopropyl-1,2,4-oxadiazol-5-yl)methyl 2-chloro-5-methylsulfanyl-benzoate CAS Name: 2-chloro-5-(methylthio)benzoic acid (3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl ester IUPAC Name: (3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl 2-chloro-5-methylsulfanylbenzoate Traditional Name: 2-chloro-5-(methylthio)benzoic acid (3-isopropyl-1,2,4-oxadiazol-5-yl)methyl ester Formula: C14H15ClN2O3S MolecularWeight: 326.7985

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NOC(=N1)COC(=O)C2=C(C=CC(=C2)SC)Cl

Isomeric SMILES

CC(C)C1=NOC(=N1)COC(=O)C2=C(C=CC(=C2)SC)Cl

InChI

InChI=1S/C14H15ClN2O3S/c1-8(2)13-16-12(20-17-13)7-19-14(18)10-6-9(21-3)4-5-11(10)15/h4-6,8H,7H2,1-3H3