ethyl 1-ethyl-4-[2-[(4-fluorophenyl)sulfonyl-propan-2-yl-amino]ethanoyl]-3,5-dimethyl-pyrrole-2-carboxylate

Systemtic Name: ethyl 1-ethyl-4-[2-[(4-fluorophenyl)sulfonyl-propan-2-yl-amino]ethanoyl]-3,5-dimethyl-pyrrole-2-carboxylate Openeye Name: ethyl 1-ethyl-4-[2-[(4-fluorophenyl)sulfonyl-isopropyl-amino]acetyl]-3,5-dimethyl-pyrrole-2-carboxylate CAS Name: 1-ethyl-4-[2-[(4-fluorophenyl)sulfonyl-propan-2-ylamino]-1-oxoethyl]-3,5-dimethyl-2-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-ethyl-4-[2-[(4-fluorophenyl)sulfonyl-propan-2-ylamino]acetyl]-3,5-dimethylpyrrole-2-carboxylate Traditional Name: 1-ethyl-4-[2-[(4-fluorophenyl)sulfonyl-isopropyl-amino]acetyl]-3,5-dimethyl-pyrrole-2-carboxylic acid ethyl ester Formula: C22H29FN2O5S MolecularWeight: 452.539463

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=C1C(=O)OCC)C)C(=O)CN(C(C)C)S(=O)(=O)C2=CC=C(C=C2)F)C

Isomeric SMILES

CCN1C(=C(C(=C1C(=O)OCC)C)C(=O)CN(C(C)C)S(=O)(=O)C2=CC=C(C=C2)F)C

InChI

InChI=1S/C22H29FN2O5S/c1-7-24-16(6)20(15(5)21(24)22(27)30-8-2)19(26)13-25(14(3)4)31(28,29)18-11-9-17(23)10-12-18/h9-12,14H,7-8,13H2,1-6H3