4-[2-pyrrolidin-1-ylcarbonyl-4-(thiophen-2-ylcarbonylamino)phenyl]-N-[3-(trifluoromethyl)phenyl]piperazine-1-carboxamide

Systemtic Name: 4-[2-pyrrolidin-1-ylcarbonyl-4-(thiophen-2-ylcarbonylamino)phenyl]-N-[3-(trifluoromethyl)phenyl]piperazine-1-carboxamide Openeye Name: 4-[2-(pyrrolidine-1-carbonyl)-4-(thiophene-2-carbonylamino)phenyl]-N-[3-(trifluoromethyl)phenyl]piperazine-1-carboxamide CAS Name: 4-[2-[oxo(1-pyrrolidinyl)methyl]-4-[[oxo(thiophen-2-yl)methyl]amino]phenyl]-N-[3-(trifluoromethyl)phenyl]-1-piperazinecarboxamide IUPAC Name: 4-[2-(pyrrolidine-1-carbonyl)-4-(thiophene-2-carbonylamino)phenyl]-N-[3-(trifluoromethyl)phenyl]piperazine-1-carboxamide Traditional Name: 4-[2-(pyrrolidine-1-carbonyl)-4-(2-thenoylamino)phenyl]-N-[3-(trifluoromethyl)phenyl]piperazine-1-carboxamide Formula: C28H28F3N5O3S MolecularWeight: 571.61383

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=C(C=CC(=C2)NC(=O)C3=CC=CS3)N4CCN(CC4)C(=O)NC5=CC=CC(=C5)C(F)(F)F

Isomeric SMILES

C1CCN(C1)C(=O)C2=C(C=CC(=C2)NC(=O)C3=CC=CS3)N4CCN(CC4)C(=O)NC5=CC=CC(=C5)C(F)(F)F

InChI

InChI=1S/C28H28F3N5O3S/c29-28(30,31)19-5-3-6-20(17-19)33-27(39)36-14-12-34(13-15-36)23-9-8-21(32-25(37)24-7-4-16-40-24)18-22(23)26(38)35-10-1-2-11-35/h3-9,16-18H,1-2,10-15H2,(H,32,37)(H,33,39)