dimethyl-[(1S)-2-[(2-morpholin-4-ylpyridin-3-yl)carbonylamino]-1-thiophen-3-yl-ethyl]azanium

Systemtic Name: dimethyl-[(1S)-2-[(2-morpholin-4-ylpyridin-3-yl)carbonylamino]-1-thiophen-3-yl-ethyl]azanium Openeye Name: dimethyl-[(1S)-2-[(2-morpholinopyridine-3-carbonyl)amino]-1-(3-thienyl)ethyl]ammonium CAS Name: dimethyl-[(1S)-2-[[[2-(4-morpholinyl)-3-pyridinyl]-oxomethyl]amino]-1-(3-thiophenyl)ethyl]ammonium IUPAC Name: dimethyl-[(1S)-2-[(2-morpholin-4-ylpyridine-3-carbonyl)amino]-1-thiophen-3-ylethyl]azanium Traditional Name: dimethyl-[(1S)-2-[(2-morpholinonicotinoyl)amino]-1-(3-thienyl)ethyl]ammonium Formula: C18H25N4O2S+ MolecularWeight: 361.4817

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C(CNC(=O)C1=C(N=CC=C1)N2CCOCC2)C3=CSC=C3

Isomeric SMILES

C[NH+](C)[C@H](CNC(=O)C1=C(N=CC=C1)N2CCOCC2)C3=CSC=C3

InChI

InChI=1S/C18H24N4O2S/c1-21(2)16(14-5-11-25-13-14)12-20-18(23)15-4-3-6-19-17(15)22-7-9-24-10-8-22/h3-6,11,13,16H,7-10,12H2,1-2H3,(H,20,23)/p+1/t16-/m1/s1