[2-[2-(2-methoxyphenyl)ethylamino]-2-oxidanylidene-ethyl] 2-(2,5-dimethylpyrrol-1-yl)thiophene-3-carboxylate

Systemtic Name: [2-[2-(2-methoxyphenyl)ethylamino]-2-oxidanylidene-ethyl] 2-(2,5-dimethylpyrrol-1-yl)thiophene-3-carboxylate Openeye Name: [2-[2-(2-methoxyphenyl)ethylamino]-2-oxo-ethyl] 2-(2,5-dimethylpyrrol-1-yl)thiophene-3-carboxylate CAS Name: 2-(2,5-dimethyl-1-pyrrolyl)-3-thiophenecarboxylic acid [2-[2-(2-methoxyphenyl)ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[2-(2-methoxyphenyl)ethylamino]-2-oxoethyl] 2-(2,5-dimethylpyrrol-1-yl)thiophene-3-carboxylate Traditional Name: 2-(2,5-dimethylpyrrol-1-yl)thiophene-3-carboxylic acid [2-keto-2-[2-(2-methoxyphenyl)ethylamino]ethyl] ester Formula: C22H24N2O4S MolecularWeight: 412.50196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=C(C=CS2)C(=O)OCC(=O)NCCC3=CC=CC=C3OC)C

Isomeric SMILES

CC1=CC=C(N1C2=C(C=CS2)C(=O)OCC(=O)NCCC3=CC=CC=C3OC)C

InChI

InChI=1S/C22H24N2O4S/c1-15-8-9-16(2)24(15)21-18(11-13-29-21)22(26)28-14-20(25)23-12-10-17-6-4-5-7-19(17)27-3/h4-9,11,13H,10,12,14H2,1-3H3,(H,23,25)