[(1S)-2-[[(3S)-1-ethanoylpiperidin-3-yl]carbonylamino]-1-thiophen-3-yl-ethyl]-diethyl-azanium

Systemtic Name: [(1S)-2-[[(3S)-1-ethanoylpiperidin-3-yl]carbonylamino]-1-thiophen-3-yl-ethyl]-diethyl-azanium Openeye Name: [(1S)-2-[[(3S)-1-acetylpiperidine-3-carbonyl]amino]-1-(3-thienyl)ethyl]-diethyl-ammonium CAS Name: [(1S)-2-[[[(3S)-1-acetyl-3-piperidinyl]-oxomethyl]amino]-1-(3-thiophenyl)ethyl]-diethylammonium IUPAC Name: [(1S)-2-[[(3S)-1-acetylpiperidine-3-carbonyl]amino]-1-thiophen-3-ylethyl]-diethylazanium Traditional Name: [(1S)-2-[[(3S)-1-acetylnipecotoyl]amino]-1-(3-thienyl)ethyl]-diethyl-ammonium Formula: C18H30N3O2S+ MolecularWeight: 352.5147

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)C(CNC(=O)C1CCCN(C1)C(=O)C)C2=CSC=C2

Isomeric SMILES

CC[NH+](CC)[C@H](CNC(=O)[C@H]1CCCN(C1)C(=O)C)C2=CSC=C2

InChI

InChI=1S/C18H29N3O2S/c1-4-20(5-2)17(16-8-10-24-13-16)11-19-18(23)15-7-6-9-21(12-15)14(3)22/h8,10,13,15,17H,4-7,9,11-12H2,1-3H3,(H,19,23)/p+1/t15-,17+/m0/s1