[3-(4-fluorophenyl)imidazol-4-yl]-[4-(thiophen-3-ylmethyl)piperazin-4-ium-1-yl]methanone

Systemtic Name: [3-(4-fluorophenyl)imidazol-4-yl]-[4-(thiophen-3-ylmethyl)piperazin-4-ium-1-yl]methanone Openeye Name: [3-(4-fluorophenyl)imidazol-4-yl]-[4-(3-thienylmethyl)piperazin-4-ium-1-yl]methanone CAS Name: [3-(4-fluorophenyl)-4-imidazolyl]-[4-(3-thiophenylmethyl)-1-piperazin-4-iumyl]methanone IUPAC Name: [3-(4-fluorophenyl)imidazol-4-yl]-[4-(thiophen-3-ylmethyl)piperazin-4-ium-1-yl]methanone Traditional Name: [3-(4-fluorophenyl)imidazol-4-yl]-[4-(3-thenyl)piperazin-4-ium-1-yl]methanone Formula: C19H20FN4OS+ MolecularWeight: 371.451703

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CSC=C2)C(=O)C3=CN=CN3C4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CC[NH+]1CC2=CSC=C2)C(=O)C3=CN=CN3C4=CC=C(C=C4)F

InChI

InChI=1S/C19H19FN4OS/c20-16-1-3-17(4-2-16)24-14-21-11-18(24)19(25)23-8-6-22(7-9-23)12-15-5-10-26-13-15/h1-5,10-11,13-14H,6-9,12H2/p+1