methyl 5-methylsulfonyl-4-(4-phenyl-1,3-thiazol-2-yl)thiophene-2-carboxylate

Systemtic Name: methyl 5-methylsulfonyl-4-(4-phenyl-1,3-thiazol-2-yl)thiophene-2-carboxylate Openeye Name: methyl 5-methylsulfonyl-4-(4-phenylthiazol-2-yl)thiophene-2-carboxylate CAS Name: 5-methylsulfonyl-4-(4-phenyl-2-thiazolyl)-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-methylsulfonyl-4-(4-phenyl-1,3-thiazol-2-yl)thiophene-2-carboxylate Traditional Name: 5-mesyl-4-(4-phenylthiazol-2-yl)thiophene-2-carboxylic acid methyl ester Formula: C16H13NO4S3 MolecularWeight: 379.47372

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(S1)S(=O)(=O)C)C2=NC(=CS2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC(=C(S1)S(=O)(=O)C)C2=NC(=CS2)C3=CC=CC=C3

InChI

InChI=1S/C16H13NO4S3/c1-21-15(18)13-8-11(16(23-13)24(2,19)20)14-17-12(9-22-14)10-6-4-3-5-7-10/h3-9H,1-2H3