N-(1,2-oxazol-3-ylmethyl)-2-[(2R)-3-oxidanylidene-1-(thiophen-2-ylmethyl)piperazin-1-ium-2-yl]ethanamide

Systemtic Name: N-(1,2-oxazol-3-ylmethyl)-2-[(2R)-3-oxidanylidene-1-(thiophen-2-ylmethyl)piperazin-1-ium-2-yl]ethanamide Openeye Name: N-(isoxazol-3-ylmethyl)-2-[(2R)-3-oxo-1-(2-thienylmethyl)piperazin-1-ium-2-yl]acetamide CAS Name: N-(3-isoxazolylmethyl)-2-[(2R)-3-oxo-1-(thiophen-2-ylmethyl)-2-piperazin-1-iumyl]acetamide IUPAC Name: N-(1,2-oxazol-3-ylmethyl)-2-[(2R)-3-oxo-1-(thiophen-2-ylmethyl)piperazin-1-ium-2-yl]acetamide Traditional Name: N-(isoxazol-3-ylmethyl)-2-[(2R)-3-keto-1-(2-thenyl)piperazin-1-ium-2-yl]acetamide Formula: C15H19N4O3S+ MolecularWeight: 335.40136

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](C(C(=O)N1)CC(=O)NCC2=NOC=C2)CC3=CC=CS3

Isomeric SMILES

C1C[NH+]([C@@H](C(=O)N1)CC(=O)NCC2=NOC=C2)CC3=CC=CS3

InChI

InChI=1S/C15H18N4O3S/c20-14(17-9-11-3-6-22-18-11)8-13-15(21)16-4-5-19(13)10-12-2-1-7-23-12/h1-3,6-7,13H,4-5,8-10H2,(H,16,21)(H,17,20)/p+1/t13-/m1/s1