[(2S)-1-(1H-indazol-6-ylamino)-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]azanium

Systemtic Name: [(2S)-1-(1H-indazol-6-ylamino)-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]azanium Openeye Name: [(1S)-1-(1H-indazol-6-ylcarbamoyl)-3-methylsulfanyl-propyl]ammonium CAS Name: [(2S)-1-(1H-indazol-6-ylamino)-4-(methylthio)-1-oxobutan-2-yl]ammonium IUPAC Name: [(2S)-1-(1H-indazol-6-ylamino)-4-methylsulfanyl-1-oxobutan-2-yl]azanium Traditional Name: [(1S)-1-(1H-indazol-6-ylcarbamoyl)-3-(methylthio)propyl]ammonium Formula: C12H17N4OS+ MolecularWeight: 265.35458

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NC1=CC2=C(C=C1)C=NN2)[NH3+]

Isomeric SMILES

CSCC[C@@H](C(=O)NC1=CC2=C(C=C1)C=NN2)[NH3+]

InChI

InChI=1S/C12H16N4OS/c1-18-5-4-10(13)12(17)15-9-3-2-8-7-14-16-11(8)6-9/h2-3,6-7,10H,4-5,13H2,1H3,(H,14,16)(H,15,17)/p+1/t10-/m0/s1