methyl 2-[2-(2,6-dimethylpiperidin-1-yl)ethanoylamino]-4-phenyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[2-(2,6-dimethylpiperidin-1-yl)ethanoylamino]-4-phenyl-thiophene-3-carboxylate Openeye Name: methyl 2-[[2-(2,6-dimethyl-1-piperidyl)acetyl]amino]-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[2-(2,6-dimethyl-1-piperidinyl)-1-oxoethyl]amino]-4-phenyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[2-(2,6-dimethylpiperidin-1-yl)acetyl]amino]-4-phenylthiophene-3-carboxylate Traditional Name: 2-[[2-(2,6-dimethylpiperidino)acetyl]amino]-4-phenyl-thiophene-3-carboxylic acid methyl ester Formula: C21H26N2O3S MolecularWeight: 386.50774

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1CC(=O)NC2=C(C(=CS2)C3=CC=CC=C3)C(=O)OC)C

Isomeric SMILES

CC1CCCC(N1CC(=O)NC2=C(C(=CS2)C3=CC=CC=C3)C(=O)OC)C

InChI

InChI=1S/C21H26N2O3S/c1-14-8-7-9-15(2)23(14)12-18(24)22-20-19(21(25)26-3)17(13-27-20)16-10-5-4-6-11-16/h4-6,10-11,13-15H,7-9,12H2,1-3H3,(H,22,24)