(3,4-dimethylphenyl) 4-pyrrolidin-1-ylsulfonylthiophene-2-carboxylate

Systemtic Name: (3,4-dimethylphenyl) 4-pyrrolidin-1-ylsulfonylthiophene-2-carboxylate Openeye Name: (3,4-dimethylphenyl) 4-pyrrolidin-1-ylsulfonylthiophene-2-carboxylate CAS Name: 4-(1-pyrrolidinylsulfonyl)-2-thiophenecarboxylic acid (3,4-dimethylphenyl) ester IUPAC Name: (3,4-dimethylphenyl) 4-pyrrolidin-1-ylsulfonylthiophene-2-carboxylate Traditional Name: 4-pyrrolidinosulfonylthiophene-2-carboxylic acid (3,4-dimethylphenyl) ester Formula: C17H19NO4S2 MolecularWeight: 365.46706

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OC(=O)C2=CC(=CS2)S(=O)(=O)N3CCCC3)C

Isomeric SMILES

CC1=C(C=C(C=C1)OC(=O)C2=CC(=CS2)S(=O)(=O)N3CCCC3)C

InChI

InChI=1S/C17H19NO4S2/c1-12-5-6-14(9-13(12)2)22-17(19)16-10-15(11-23-16)24(20,21)18-7-3-4-8-18/h5-6,9-11H,3-4,7-8H2,1-2H3