4-[4-[5-ethyl-1-(4-fluorophenyl)pyrazol-4-yl]carbonylpiperazin-1-yl]sulfonyl-1-methyl-pyrrole-2-carboxamide

Systemtic Name: 4-[4-[5-ethyl-1-(4-fluorophenyl)pyrazol-4-yl]carbonylpiperazin-1-yl]sulfonyl-1-methyl-pyrrole-2-carboxamide Openeye Name: 4-[4-[5-ethyl-1-(4-fluorophenyl)pyrazole-4-carbonyl]piperazin-1-yl]sulfonyl-1-methyl-pyrrole-2-carboxamide CAS Name: 4-[[4-[[5-ethyl-1-(4-fluorophenyl)-4-pyrazolyl]-oxomethyl]-1-piperazinyl]sulfonyl]-1-methyl-2-pyrrolecarboxamide IUPAC Name: 4-[4-[5-ethyl-1-(4-fluorophenyl)pyrazole-4-carbonyl]piperazin-1-yl]sulfonyl-1-methylpyrrole-2-carboxamide Traditional Name: 4-[4-[5-ethyl-1-(4-fluorophenyl)pyrazole-4-carbonyl]piperazino]sulfonyl-1-methyl-pyrrole-2-carboxamide Formula: C22H25FN6O4S MolecularWeight: 488.535103

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=NN1C2=CC=C(C=C2)F)C(=O)N3CCN(CC3)S(=O)(=O)C4=CN(C(=C4)C(=O)N)C

Isomeric SMILES

CCC1=C(C=NN1C2=CC=C(C=C2)F)C(=O)N3CCN(CC3)S(=O)(=O)C4=CN(C(=C4)C(=O)N)C

InChI

InChI=1S/C22H25FN6O4S/c1-3-19-18(13-25-29(19)16-6-4-15(23)5-7-16)22(31)27-8-10-28(11-9-27)34(32,33)17-12-20(21(24)30)26(2)14-17/h4-7,12-14H,3,8-11H2,1-2H3,(H2,24,30)