N-[(2S)-2-piperidin-1-ium-1-yl-2-thiophen-2-yl-ethyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide

Systemtic Name: N-[(2S)-2-piperidin-1-ium-1-yl-2-thiophen-2-yl-ethyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide Openeye Name: N-[(2S)-2-piperidin-1-ium-1-yl-2-(2-thienyl)ethyl]-5-(2-thienyl)isoxazole-3-carboxamide CAS Name: N-[(2S)-2-(1-piperidin-1-iumyl)-2-thiophen-2-ylethyl]-5-thiophen-2-yl-3-isoxazolecarboxamide IUPAC Name: N-[(2S)-2-piperidin-1-ium-1-yl-2-thiophen-2-ylethyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide Traditional Name: N-[(2S)-2-piperidin-1-ium-1-yl-2-(2-thienyl)ethyl]-5-(2-thienyl)isoxazole-3-carboxamide Formula: C19H22N3O2S2+ MolecularWeight: 388.52688

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)C(CNC(=O)C2=NOC(=C2)C3=CC=CS3)C4=CC=CS4

Isomeric SMILES

C1CC[NH+](CC1)[C@@H](CNC(=O)C2=NOC(=C2)C3=CC=CS3)C4=CC=CS4

InChI

InChI=1S/C19H21N3O2S2/c23-19(14-12-16(24-21-14)18-7-5-11-26-18)20-13-15(17-6-4-10-25-17)22-8-2-1-3-9-22/h4-7,10-12,15H,1-3,8-9,13H2,(H,20,23)/p+1/t15-/m0/s1