methyl 4-tert-butylsulfonyl-3-pyrrol-1-yl-thiophene-2-carboxylate

Systemtic Name: methyl 4-tert-butylsulfonyl-3-pyrrol-1-yl-thiophene-2-carboxylate Openeye Name: methyl 4-tert-butylsulfonyl-3-pyrrol-1-yl-thiophene-2-carboxylate CAS Name: 4-tert-butylsulfonyl-3-(1-pyrrolyl)-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-tert-butylsulfonyl-3-pyrrol-1-ylthiophene-2-carboxylate Traditional Name: 4-tert-butylsulfonyl-3-pyrrol-1-yl-thiophene-2-carboxylic acid methyl ester Formula: C14H17NO4S2 MolecularWeight: 327.41908

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)S(=O)(=O)C1=CSC(=C1N2C=CC=C2)C(=O)OC

Isomeric SMILES

CC(C)(C)S(=O)(=O)C1=CSC(=C1N2C=CC=C2)C(=O)OC

InChI

InChI=1S/C14H17NO4S2/c1-14(2,3)21(17,18)10-9-20-12(13(16)19-4)11(10)15-7-5-6-8-15/h5-9H,1-4H3