(4-methylphenyl)methyl 3-pyrrolidin-1-ylsulfonylthiophene-2-carboxylate

Systemtic Name: (4-methylphenyl)methyl 3-pyrrolidin-1-ylsulfonylthiophene-2-carboxylate Openeye Name: p-tolylmethyl 3-pyrrolidin-1-ylsulfonylthiophene-2-carboxylate CAS Name: 3-(1-pyrrolidinylsulfonyl)-2-thiophenecarboxylic acid (4-methylphenyl)methyl ester IUPAC Name: (4-methylphenyl)methyl 3-pyrrolidin-1-ylsulfonylthiophene-2-carboxylate Traditional Name: 3-pyrrolidinosulfonylthiophene-2-carboxylic acid (4-methylbenzyl) ester Formula: C17H19NO4S2 MolecularWeight: 365.46706

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19NO4S2/c1-13-4-6-14(7-5-13)12-22-17(19)16-15(8-11-23-16)24(20,21)18-9-2-3-10-18/h4-8,11H,2-3,9-10,12H2,1H3