4-[4-[2-(2-fluoranylphenoxy)propanoyl]piperazin-1-yl]sulfonyl-1-methyl-pyrrole-2-carboxamide

Systemtic Name: 4-[4-[2-(2-fluoranylphenoxy)propanoyl]piperazin-1-yl]sulfonyl-1-methyl-pyrrole-2-carboxamide Openeye Name: 4-[4-[2-(2-fluorophenoxy)propanoyl]piperazin-1-yl]sulfonyl-1-methyl-pyrrole-2-carboxamide CAS Name: 4-[[4-[2-(2-fluorophenoxy)-1-oxopropyl]-1-piperazinyl]sulfonyl]-1-methyl-2-pyrrolecarboxamide IUPAC Name: 4-[4-[2-(2-fluorophenoxy)propanoyl]piperazin-1-yl]sulfonyl-1-methylpyrrole-2-carboxamide Traditional Name: 4-[4-[2-(2-fluorophenoxy)propanoyl]piperazino]sulfonyl-1-methyl-pyrrole-2-carboxamide Formula: C19H23FN4O5S MolecularWeight: 438.473123

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)S(=O)(=O)C2=CN(C(=C2)C(=O)N)C)OC3=CC=CC=C3F

Isomeric SMILES

CC(C(=O)N1CCN(CC1)S(=O)(=O)C2=CN(C(=C2)C(=O)N)C)OC3=CC=CC=C3F

InChI

InChI=1S/C19H23FN4O5S/c1-13(29-17-6-4-3-5-15(17)20)19(26)23-7-9-24(10-8-23)30(27,28)14-11-16(18(21)25)22(2)12-14/h3-6,11-13H,7-10H2,1-2H3,(H2,21,25)