(5-chloranyl-1,2,3-thiadiazol-4-yl)methyl 2-[(4-methylphenyl)sulfonylamino]ethanoate

Systemtic Name: (5-chloranyl-1,2,3-thiadiazol-4-yl)methyl 2-[(4-methylphenyl)sulfonylamino]ethanoate Openeye Name: (5-chlorothiadiazol-4-yl)methyl 2-(p-tolylsulfonylamino)acetate CAS Name: 2-[(4-methylphenyl)sulfonylamino]acetic acid (5-chloro-4-thiadiazolyl)methyl ester IUPAC Name: (5-chlorothiadiazol-4-yl)methyl 2-[(4-methylphenyl)sulfonylamino]acetate Traditional Name: 2-(tosylamino)acetic acid (5-chlorothiadiazol-4-yl)methyl ester Formula: C12H12ClN3O4S2 MolecularWeight: 361.82438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCC(=O)OCC2=C(SN=N2)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCC(=O)OCC2=C(SN=N2)Cl

InChI

InChI=1S/C12H12ClN3O4S2/c1-8-2-4-9(5-3-8)22(18,19)14-6-11(17)20-7-10-12(13)21-16-15-10/h2-5,14H,6-7H2,1H3