[3-[(1S)-1-azaniumylethyl]phenyl]sulfonyl-pyrimidin-2-yl-azanide

Systemtic Name: [3-[(1S)-1-azaniumylethyl]phenyl]sulfonyl-pyrimidin-2-yl-azanide Openeye Name: [3-[(1S)-1-azaniumylethyl]phenyl]sulfonyl-pyrimidin-2-yl-azanide CAS Name: [3-[(1S)-1-ammonioethyl]phenyl]sulfonyl-(2-pyrimidinyl)azanide IUPAC Name: [3-[(1S)-1-azaniumylethyl]phenyl]sulfonyl-pyrimidin-2-ylazanide Traditional Name: [3-[(1S)-1-ammonioethyl]phenyl]sulfonyl-(2-pyrimidyl)azanide Formula: C12H14N4O2S MolecularWeight: 278.33016

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)S(=O)(=O)[N-]C2=NC=CC=N2)[NH3+]

Isomeric SMILES

C[C@@H](C1=CC(=CC=C1)S(=O)(=O)[N-]C2=NC=CC=N2)[NH3+]

InChI

InChI=1S/C12H13N4O2S/c1-9(13)10-4-2-5-11(8-10)19(17,18)16-12-14-6-3-7-15-12/h2-9H,13H2,1H3/q-1/p+1/t9-/m0/s1