[2-[(4-chloranylphenoxy)methyl]-1,3-thiazol-4-yl]methyl 4-methylsulfonylbenzoate

Systemtic Name: [2-[(4-chloranylphenoxy)methyl]-1,3-thiazol-4-yl]methyl 4-methylsulfonylbenzoate Openeye Name: [2-[(4-chlorophenoxy)methyl]thiazol-4-yl]methyl 4-methylsulfonylbenzoate CAS Name: 4-methylsulfonylbenzoic acid [2-[(4-chlorophenoxy)methyl]-4-thiazolyl]methyl ester IUPAC Name: [2-[(4-chlorophenoxy)methyl]-1,3-thiazol-4-yl]methyl 4-methylsulfonylbenzoate Traditional Name: 4-mesylbenzoic acid [2-[(4-chlorophenoxy)methyl]thiazol-4-yl]methyl ester Formula: C19H16ClNO5S2 MolecularWeight: 437.91704

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C(=O)OCC2=CSC(=N2)COC3=CC=C(C=C3)Cl

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C(=O)OCC2=CSC(=N2)COC3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H16ClNO5S2/c1-28(23,24)17-8-2-13(3-9-17)19(22)26-10-15-12-27-18(21-15)11-25-16-6-4-14(20)5-7-16/h2-9,12H,10-11H2,1H3