(2,4-dimethylphenyl) 1-(5-chloranylthiophen-2-yl)sulfonylpyrrolidine-2-carboxylate

Systemtic Name: (2,4-dimethylphenyl) 1-(5-chloranylthiophen-2-yl)sulfonylpyrrolidine-2-carboxylate Openeye Name: (2,4-dimethylphenyl) 1-[(5-chloro-2-thienyl)sulfonyl]pyrrolidine-2-carboxylate CAS Name: 1-[(5-chloro-2-thiophenyl)sulfonyl]-2-pyrrolidinecarboxylic acid (2,4-dimethylphenyl) ester IUPAC Name: (2,4-dimethylphenyl) 1-(5-chlorothiophen-2-yl)sulfonylpyrrolidine-2-carboxylate Traditional Name: 1-[(5-chloro-2-thienyl)sulfonyl]pyrrolidine-2-carboxylic acid (2,4-dimethylphenyl) ester Formula: C17H18ClNO4S2 MolecularWeight: 399.91212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC(=O)C2CCCN2S(=O)(=O)C3=CC=C(S3)Cl)C

Isomeric SMILES

CC1=CC(=C(C=C1)OC(=O)C2CCCN2S(=O)(=O)C3=CC=C(S3)Cl)C

InChI

InChI=1S/C17H18ClNO4S2/c1-11-5-6-14(12(2)10-11)23-17(20)13-4-3-9-19(13)25(21,22)16-8-7-15(18)24-16/h5-8,10,13H,3-4,9H2,1-2H3