[2-oxidanylidene-2-[phenethyl(thiophen-2-ylmethyl)amino]ethyl] 4-ethanoyl-1H-pyrrole-2-carboxylate

Systemtic Name: [2-oxidanylidene-2-[phenethyl(thiophen-2-ylmethyl)amino]ethyl] 4-ethanoyl-1H-pyrrole-2-carboxylate Openeye Name: [2-oxo-2-[phenethyl(2-thienylmethyl)amino]ethyl] 4-acetyl-1H-pyrrole-2-carboxylate CAS Name: 4-acetyl-1H-pyrrole-2-carboxylic acid [2-oxo-2-[phenethyl(thiophen-2-ylmethyl)amino]ethyl] ester IUPAC Name: [2-oxo-2-[phenethyl(thiophen-2-ylmethyl)amino]ethyl] 4-acetyl-1H-pyrrole-2-carboxylate Traditional Name: 4-acetyl-1H-pyrrole-2-carboxylic acid [2-keto-2-[phenethyl(2-thenyl)amino]ethyl] ester Formula: C22H22N2O4S MolecularWeight: 410.48608

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CNC(=C1)C(=O)OCC(=O)N(CCC2=CC=CC=C2)CC3=CC=CS3

Isomeric SMILES

CC(=O)C1=CNC(=C1)C(=O)OCC(=O)N(CCC2=CC=CC=C2)CC3=CC=CS3

InChI

InChI=1S/C22H22N2O4S/c1-16(25)18-12-20(23-13-18)22(27)28-15-21(26)24(14-19-8-5-11-29-19)10-9-17-6-3-2-4-7-17/h2-8,11-13,23H,9-10,14-15H2,1H3