dimethyl-[(1S)-2-(pyrazin-2-ylcarbonylamino)-1-thiophen-3-yl-ethyl]azanium

Systemtic Name: dimethyl-[(1S)-2-(pyrazin-2-ylcarbonylamino)-1-thiophen-3-yl-ethyl]azanium Openeye Name: dimethyl-[(1S)-2-(pyrazine-2-carbonylamino)-1-(3-thienyl)ethyl]ammonium CAS Name: dimethyl-[(1S)-2-[[oxo(2-pyrazinyl)methyl]amino]-1-(3-thiophenyl)ethyl]ammonium IUPAC Name: dimethyl-[(1S)-2-(pyrazine-2-carbonylamino)-1-thiophen-3-ylethyl]azanium Traditional Name: dimethyl-[(1S)-2-(pyrazinoylamino)-1-(3-thienyl)ethyl]ammonium Formula: C13H17N4OS+ MolecularWeight: 277.36528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C(CNC(=O)C1=NC=CN=C1)C2=CSC=C2

Isomeric SMILES

C[NH+](C)[C@H](CNC(=O)C1=NC=CN=C1)C2=CSC=C2

InChI

InChI=1S/C13H16N4OS/c1-17(2)12(10-3-6-19-9-10)8-16-13(18)11-7-14-4-5-15-11/h3-7,9,12H,8H2,1-2H3,(H,16,18)/p+1/t12-/m1/s1