[4-[(4-fluorophenyl)methyl]piperazin-4-ium-1-yl]-(5-propan-2-ylthiophen-3-yl)methanone

Systemtic Name: [4-[(4-fluorophenyl)methyl]piperazin-4-ium-1-yl]-(5-propan-2-ylthiophen-3-yl)methanone Openeye Name: [4-[(4-fluorophenyl)methyl]piperazin-4-ium-1-yl]-(5-isopropyl-3-thienyl)methanone CAS Name: [4-[(4-fluorophenyl)methyl]-1-piperazin-4-iumyl]-(5-propan-2-yl-3-thiophenyl)methanone IUPAC Name: [4-[(4-fluorophenyl)methyl]piperazin-4-ium-1-yl]-(5-propan-2-ylthiophen-3-yl)methanone Traditional Name: [4-(4-fluorobenzyl)piperazin-4-ium-1-yl]-(5-isopropyl-3-thienyl)methanone Formula: C19H24FN2OS+ MolecularWeight: 347.470063

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=CS1)C(=O)N2CC[NH+](CC2)CC3=CC=C(C=C3)F

Isomeric SMILES

CC(C)C1=CC(=CS1)C(=O)N2CC[NH+](CC2)CC3=CC=C(C=C3)F

InChI

InChI=1S/C19H23FN2OS/c1-14(2)18-11-16(13-24-18)19(23)22-9-7-21(8-10-22)12-15-3-5-17(20)6-4-15/h3-6,11,13-14H,7-10,12H2,1-2H3/p+1