(2-thiophen-3-yl-1,3-thiazol-4-yl)methyl 3-methylsulfonylbenzoate

Systemtic Name: (2-thiophen-3-yl-1,3-thiazol-4-yl)methyl 3-methylsulfonylbenzoate Openeye Name: [2-(3-thienyl)thiazol-4-yl]methyl 3-methylsulfonylbenzoate CAS Name: 3-methylsulfonylbenzoic acid [2-(3-thiophenyl)-4-thiazolyl]methyl ester IUPAC Name: (2-thiophen-3-yl-1,3-thiazol-4-yl)methyl 3-methylsulfonylbenzoate Traditional Name: 3-mesylbenzoic acid [2-(3-thienyl)thiazol-4-yl]methyl ester Formula: C16H13NO4S3 MolecularWeight: 379.47372

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13NO4S3/c1-24(19,20)14-4-2-3-11(7-14)16(18)21-8-13-10-23-15(17-13)12-5-6-22-9-12/h2-7,9-10H,8H2,1H3