N-[3-cyano-4-[4-(2-hydroxyethyl)piperazin-1-yl]phenyl]-1-(4-fluorophenyl)pyrrole-2-carboxamide

Systemtic Name: N-[3-cyano-4-[4-(2-hydroxyethyl)piperazin-1-yl]phenyl]-1-(4-fluorophenyl)pyrrole-2-carboxamide Openeye Name: N-[3-cyano-4-[4-(2-hydroxyethyl)piperazin-1-yl]phenyl]-1-(4-fluorophenyl)pyrrole-2-carboxamide CAS Name: N-[3-cyano-4-[4-(2-hydroxyethyl)-1-piperazinyl]phenyl]-1-(4-fluorophenyl)-2-pyrrolecarboxamide IUPAC Name: N-[3-cyano-4-[4-(2-hydroxyethyl)piperazin-1-yl]phenyl]-1-(4-fluorophenyl)pyrrole-2-carboxamide Traditional Name: N-[3-cyano-4-[4-(2-hydroxyethyl)piperazino]phenyl]-1-(4-fluorophenyl)pyrrole-2-carboxamide Formula: C24H24FN5O2 MolecularWeight: 433.478063

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCO)C2=C(C=C(C=C2)NC(=O)C3=CC=CN3C4=CC=C(C=C4)F)C#N

Isomeric SMILES

C1CN(CCN1CCO)C2=C(C=C(C=C2)NC(=O)C3=CC=CN3C4=CC=C(C=C4)F)C#N

InChI

InChI=1S/C24H24FN5O2/c25-19-3-6-21(7-4-19)30-9-1-2-23(30)24(32)27-20-5-8-22(18(16-20)17-26)29-12-10-28(11-13-29)14-15-31/h1-9,16,31H,10-15H2,(H,27,32)