N-[(1R,2S)-1-(4-ethylpiperazin-4-ium-1-yl)-1-thiophen-2-yl-propan-2-yl]thiophene-2-carboxamide

Systemtic Name: N-[(1R,2S)-1-(4-ethylpiperazin-4-ium-1-yl)-1-thiophen-2-yl-propan-2-yl]thiophene-2-carboxamide Openeye Name: N-[(1S,2R)-2-(4-ethylpiperazin-4-ium-1-yl)-1-methyl-2-(2-thienyl)ethyl]thiophene-2-carboxamide CAS Name: N-[(1R,2S)-1-(4-ethyl-1-piperazin-4-iumyl)-1-thiophen-2-ylpropan-2-yl]-2-thiophenecarboxamide IUPAC Name: N-[(1R,2S)-1-(4-ethylpiperazin-4-ium-1-yl)-1-thiophen-2-ylpropan-2-yl]thiophene-2-carboxamide Traditional Name: N-[(1S,2R)-2-(4-ethylpiperazin-4-ium-1-yl)-1-methyl-2-(2-thienyl)ethyl]thiophene-2-carboxamide Formula: C18H26N3OS2+ MolecularWeight: 364.54854

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(C2=CC=CS2)C(C)NC(=O)C3=CC=CS3

Isomeric SMILES

CC[NH+]1CCN(CC1)[C@@H](C2=CC=CS2)[C@H](C)NC(=O)C3=CC=CS3

InChI

InChI=1S/C18H25N3OS2/c1-3-20-8-10-21(11-9-20)17(15-6-4-12-23-15)14(2)19-18(22)16-7-5-13-24-16/h4-7,12-14,17H,3,8-11H2,1-2H3,(H,19,22)/p+1/t14-,17+/m0/s1