N-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-1-ium-3-yl]-2-propan-2-yl-1,3-thiazole-4-carboxamide

Systemtic Name: N-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-1-ium-3-yl]-2-propan-2-yl-1,3-thiazole-4-carboxamide Openeye Name: N-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-1-ium-3-yl]-2-isopropyl-thiazole-4-carboxamide CAS Name: N-[(3S)-1-[(2-fluorophenyl)methyl]-3-piperidin-1-iumyl]-2-propan-2-yl-4-thiazolecarboxamide IUPAC Name: N-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-1-ium-3-yl]-2-propan-2-yl-1,3-thiazole-4-carboxamide Traditional Name: N-[(3S)-1-(2-fluorobenzyl)piperidin-1-ium-3-yl]-2-isopropyl-thiazole-4-carboxamide Formula: C19H25FN3OS+ MolecularWeight: 362.484703

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC(=CS1)C(=O)NC2CCC[NH+](C2)CC3=CC=CC=C3F

Isomeric SMILES

CC(C)C1=NC(=CS1)C(=O)N[C@H]2CCC[NH+](C2)CC3=CC=CC=C3F

InChI

InChI=1S/C19H24FN3OS/c1-13(2)19-22-17(12-25-19)18(24)21-15-7-5-9-23(11-15)10-14-6-3-4-8-16(14)20/h3-4,6,8,12-13,15H,5,7,9-11H2,1-2H3,(H,21,24)/p+1/t15-/m0/s1