methyl 4-methyl-3-[2-(2-thiophen-2-ylpyrrolidin-1-yl)ethanoylamino]benzoate

Systemtic Name: methyl 4-methyl-3-[2-(2-thiophen-2-ylpyrrolidin-1-yl)ethanoylamino]benzoate Openeye Name: methyl 4-methyl-3-[[2-[2-(2-thienyl)pyrrolidin-1-yl]acetyl]amino]benzoate CAS Name: 4-methyl-3-[[1-oxo-2-(2-thiophen-2-yl-1-pyrrolidinyl)ethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-methyl-3-[[2-(2-thiophen-2-ylpyrrolidin-1-yl)acetyl]amino]benzoate Traditional Name: 4-methyl-3-[[2-[2-(2-thienyl)pyrrolidino]acetyl]amino]benzoic acid methyl ester Formula: C19H22N2O3S MolecularWeight: 358.45458

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CN2CCCC2C3=CC=CS3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CN2CCCC2C3=CC=CS3

InChI

InChI=1S/C19H22N2O3S/c1-13-7-8-14(19(23)24-2)11-15(13)20-18(22)12-21-9-3-5-16(21)17-6-4-10-25-17/h4,6-8,10-11,16H,3,5,9,12H2,1-2H3,(H,20,22)