1-(3-azanyl-5-phenylazanyl-4-piperazin-1-ylcarbonyl-thiophen-2-yl)-2,2,2-tris(fluoranyl)ethanone

Systemtic Name: 1-(3-azanyl-5-phenylazanyl-4-piperazin-1-ylcarbonyl-thiophen-2-yl)-2,2,2-tris(fluoranyl)ethanone Openeye Name: 1-[3-amino-5-anilino-4-(piperazine-1-carbonyl)-2-thienyl]-2,2,2-trifluoro-ethanone CAS Name: 1-[3-amino-5-anilino-4-[oxo(1-piperazinyl)methyl]-2-thiophenyl]-2,2,2-trifluoroethanone IUPAC Name: 1-[3-amino-5-anilino-4-(piperazine-1-carbonyl)thiophen-2-yl]-2,2,2-trifluoroethanone Traditional Name: 1-[3-amino-5-anilino-4-(piperazine-1-carbonyl)-2-thienyl]-2,2,2-trifluoro-ethanone Formula: C17H17F3N4O2S MolecularWeight: 398.40269

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C(=O)C2=C(SC(=C2N)C(=O)C(F)(F)F)NC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1)C(=O)C2=C(SC(=C2N)C(=O)C(F)(F)F)NC3=CC=CC=C3

InChI

InChI=1S/C17H17F3N4O2S/c18-17(19,20)14(25)13-12(21)11(16(26)24-8-6-22-7-9-24)15(27-13)23-10-4-2-1-3-5-10/h1-5,22-23H,6-9,21H2