3-nitro-4-(4-thiophen-2-ylcarbonylpiperazin-1-yl)-1-[2,2,2-tris(fluoranyl)ethyl]quinolin-2-one

Systemtic Name: 3-nitro-4-(4-thiophen-2-ylcarbonylpiperazin-1-yl)-1-[2,2,2-tris(fluoranyl)ethyl]quinolin-2-one Openeye Name: 3-nitro-4-[4-(thiophene-2-carbonyl)piperazin-1-yl]-1-(2,2,2-trifluoroethyl)quinolin-2-one CAS Name: 3-nitro-4-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]-1-(2,2,2-trifluoroethyl)-2-quinolinone IUPAC Name: 3-nitro-4-[4-(thiophene-2-carbonyl)piperazin-1-yl]-1-(2,2,2-trifluoroethyl)quinolin-2-one Traditional Name: 3-nitro-4-[4-(2-thenoyl)piperazino]-1-(2,2,2-trifluoroethyl)carbostyril Formula: C20H17F3N4O4S MolecularWeight: 466.43359

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C(=O)N(C3=CC=CC=C32)CC(F)(F)F)[N+](=O)[O-])C(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCN1C2=C(C(=O)N(C3=CC=CC=C32)CC(F)(F)F)[N+](=O)[O-])C(=O)C4=CC=CS4

InChI

InChI=1S/C20H17F3N4O4S/c21-20(22,23)12-26-14-5-2-1-4-13(14)16(17(19(26)29)27(30)31)24-7-9-25(10-8-24)18(28)15-6-3-11-32-15/h1-6,11H,7-10,12H2