[(1S)-2-[(3-azanylpyrazin-2-yl)carbonylamino]-1-thiophen-3-yl-ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-2-[(3-azanylpyrazin-2-yl)carbonylamino]-1-thiophen-3-yl-ethyl]-dimethyl-azanium Openeye Name: [(1S)-2-[(3-aminopyrazine-2-carbonyl)amino]-1-(3-thienyl)ethyl]-dimethyl-ammonium CAS Name: [(1S)-2-[[(3-amino-2-pyrazinyl)-oxomethyl]amino]-1-(3-thiophenyl)ethyl]-dimethylammonium IUPAC Name: [(1S)-2-[(3-aminopyrazine-2-carbonyl)amino]-1-thiophen-3-ylethyl]-dimethylazanium Traditional Name: [(1S)-2-[(3-aminopyrazinoyl)amino]-1-(3-thienyl)ethyl]-dimethyl-ammonium Formula: C13H18N5OS+ MolecularWeight: 292.37992

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C(CNC(=O)C1=NC=CN=C1N)C2=CSC=C2

Isomeric SMILES

C[NH+](C)[C@H](CNC(=O)C1=NC=CN=C1N)C2=CSC=C2

InChI

InChI=1S/C13H17N5OS/c1-18(2)10(9-3-6-20-8-9)7-17-13(19)11-12(14)16-5-4-15-11/h3-6,8,10H,7H2,1-2H3,(H2,14,16)(H,17,19)/p+1/t10-/m1/s1