4-(4-fluorophenyl)sulfonyl-N-[(2S)-2-morpholin-4-ium-4-yl-2-thiophen-2-yl-ethyl]piperazine-1-carboxamide

Systemtic Name: 4-(4-fluorophenyl)sulfonyl-N-[(2S)-2-morpholin-4-ium-4-yl-2-thiophen-2-yl-ethyl]piperazine-1-carboxamide Openeye Name: 4-(4-fluorophenyl)sulfonyl-N-[(2S)-2-morpholin-4-ium-4-yl-2-(2-thienyl)ethyl]piperazine-1-carboxamide CAS Name: 4-(4-fluorophenyl)sulfonyl-N-[(2S)-2-(4-morpholin-4-iumyl)-2-thiophen-2-ylethyl]-1-piperazinecarboxamide IUPAC Name: 4-(4-fluorophenyl)sulfonyl-N-[(2S)-2-morpholin-4-ium-4-yl-2-thiophen-2-ylethyl]piperazine-1-carboxamide Traditional Name: 4-(4-fluorophenyl)sulfonyl-N-[(2S)-2-morpholin-4-ium-4-yl-2-(2-thienyl)ethyl]piperazine-1-carboxamide Formula: C21H28FN4O4S2+ MolecularWeight: 483.599823

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1C(CNC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F)C4=CC=CS4

Isomeric SMILES

C1COCC[NH+]1[C@@H](CNC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F)C4=CC=CS4

InChI

InChI=1S/C21H27FN4O4S2/c22-17-3-5-18(6-4-17)32(28,29)26-9-7-25(8-10-26)21(27)23-16-19(20-2-1-15-31-20)24-11-13-30-14-12-24/h1-6,15,19H,7-14,16H2,(H,23,27)/p+1/t19-/m0/s1