[(2S)-4-methylsulfanyl-1-oxidanylidene-1-(pyrimidin-2-ylamino)butan-2-yl]azanium

Systemtic Name: [(2S)-4-methylsulfanyl-1-oxidanylidene-1-(pyrimidin-2-ylamino)butan-2-yl]azanium Openeye Name: [(1S)-3-methylsulfanyl-1-(pyrimidin-2-ylcarbamoyl)propyl]ammonium CAS Name: [(2S)-4-(methylthio)-1-oxo-1-(2-pyrimidinylamino)butan-2-yl]ammonium IUPAC Name: [(2S)-4-methylsulfanyl-1-oxo-1-(pyrimidin-2-ylamino)butan-2-yl]azanium Traditional Name: [(1S)-3-(methylthio)-1-(2-pyrimidylcarbamoyl)propyl]ammonium Formula: C9H15N4OS+ MolecularWeight: 227.3066

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NC1=NC=CC=N1)[NH3+]

Isomeric SMILES

CSCC[C@@H](C(=O)NC1=NC=CC=N1)[NH3+]

InChI

InChI=1S/C9H14N4OS/c1-15-6-3-7(10)8(14)13-9-11-4-2-5-12-9/h2,4-5,7H,3,6,10H2,1H3,(H,11,12,13,14)/p+1/t7-/m0/s1