[2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl 3-(thiophen-2-ylsulfonylamino)propanoate

Systemtic Name: [2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl 3-(thiophen-2-ylsulfonylamino)propanoate Openeye Name: [2-(p-tolyl)thiazol-4-yl]methyl 3-(2-thienylsulfonylamino)propanoate CAS Name: 3-(thiophen-2-ylsulfonylamino)propanoic acid [2-(4-methylphenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl 3-(thiophen-2-ylsulfonylamino)propanoate Traditional Name: 3-(2-thienylsulfonylamino)propionic acid [2-(p-tolyl)thiazol-4-yl]methyl ester Formula: C18H18N2O4S3 MolecularWeight: 422.54152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=CS2)COC(=O)CCNS(=O)(=O)C3=CC=CS3

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=CS2)COC(=O)CCNS(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C18H18N2O4S3/c1-13-4-6-14(7-5-13)18-20-15(12-26-18)11-24-16(21)8-9-19-27(22,23)17-3-2-10-25-17/h2-7,10,12,19H,8-9,11H2,1H3