[2-(2-methoxyphenyl)-1,3-thiazol-4-yl]methyl 3-[(4-methylphenyl)sulfonylamino]propanoate

Systemtic Name: [2-(2-methoxyphenyl)-1,3-thiazol-4-yl]methyl 3-[(4-methylphenyl)sulfonylamino]propanoate Openeye Name: [2-(2-methoxyphenyl)thiazol-4-yl]methyl 3-(p-tolylsulfonylamino)propanoate CAS Name: 3-[(4-methylphenyl)sulfonylamino]propanoic acid [2-(2-methoxyphenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(2-methoxyphenyl)-1,3-thiazol-4-yl]methyl 3-[(4-methylphenyl)sulfonylamino]propanoate Traditional Name: 3-(tosylamino)propionic acid [2-(2-methoxyphenyl)thiazol-4-yl]methyl ester Formula: C21H22N2O5S2 MolecularWeight: 446.53978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)OCC2=CSC(=N2)C3=CC=CC=C3OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)OCC2=CSC(=N2)C3=CC=CC=C3OC

InChI

InChI=1S/C21H22N2O5S2/c1-15-7-9-17(10-8-15)30(25,26)22-12-11-20(24)28-13-16-14-29-21(23-16)18-5-3-4-6-19(18)27-2/h3-10,14,22H,11-13H2,1-2H3