4-[5-(4-chlorophenyl)-1-(3-fluorophenyl)-2-methyl-pyrrol-3-yl]carbonyl-N-ethyl-piperazine-1-carboxamide

Systemtic Name: 4-[5-(4-chlorophenyl)-1-(3-fluorophenyl)-2-methyl-pyrrol-3-yl]carbonyl-N-ethyl-piperazine-1-carboxamide Openeye Name: 4-[5-(4-chlorophenyl)-1-(3-fluorophenyl)-2-methyl-pyrrole-3-carbonyl]-N-ethyl-piperazine-1-carboxamide CAS Name: 4-[[5-(4-chlorophenyl)-1-(3-fluorophenyl)-2-methyl-3-pyrrolyl]-oxomethyl]-N-ethyl-1-piperazinecarboxamide IUPAC Name: 4-[5-(4-chlorophenyl)-1-(3-fluorophenyl)-2-methylpyrrole-3-carbonyl]-N-ethylpiperazine-1-carboxamide Traditional Name: 4-[5-(4-chlorophenyl)-1-(3-fluorophenyl)-2-methyl-pyrrole-3-carbonyl]-N-ethyl-piperazine-1-carboxamide Formula: C25H26ClFN4O2 MolecularWeight: 468.950943

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)N1CCN(CC1)C(=O)C2=C(N(C(=C2)C3=CC=C(C=C3)Cl)C4=CC(=CC=C4)F)C

Isomeric SMILES

CCNC(=O)N1CCN(CC1)C(=O)C2=C(N(C(=C2)C3=CC=C(C=C3)Cl)C4=CC(=CC=C4)F)C

InChI

InChI=1S/C25H26ClFN4O2/c1-3-28-25(33)30-13-11-29(12-14-30)24(32)22-16-23(18-7-9-19(26)10-8-18)31(17(22)2)21-6-4-5-20(27)15-21/h4-10,15-16H,3,11-14H2,1-2H3,(H,28,33)