dimethyl 3-methyl-5-[2-(2-phenylpyrrolidin-1-yl)ethanoylamino]thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 3-methyl-5-[2-(2-phenylpyrrolidin-1-yl)ethanoylamino]thiophene-2,4-dicarboxylate Openeye Name: dimethyl 3-methyl-5-[[2-(2-phenylpyrrolidin-1-yl)acetyl]amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[1-oxo-2-(2-phenyl-1-pyrrolidinyl)ethyl]amino]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-methyl-5-[[2-(2-phenylpyrrolidin-1-yl)acetyl]amino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[[2-(2-phenylpyrrolidino)acetyl]amino]thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C21H24N2O5S MolecularWeight: 416.49066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)CN2CCCC2C3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)CN2CCCC2C3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C21H24N2O5S/c1-13-17(20(25)27-2)19(29-18(13)21(26)28-3)22-16(24)12-23-11-7-10-15(23)14-8-5-4-6-9-14/h4-6,8-9,15H,7,10-12H2,1-3H3,(H,22,24)