N-(4,6-dimethoxypyrimidin-2-yl)-N'-[3-[(S)-ethoxysulfinyl]pyridin-2-yl]sulfonyl-carbamimidate

Systemtic Name: N-(4,6-dimethoxypyrimidin-2-yl)-N'-[3-[(S)-ethoxysulfinyl]pyridin-2-yl]sulfonyl-carbamimidate Openeye Name: N-(4,6-dimethoxypyrimidin-2-yl)-N'-[[3-[(S)-ethoxysulfinyl]-2-pyridyl]sulfonyl]carbamimidate CAS Name: N-(4,6-dimethoxy-2-pyrimidinyl)-N'-[[3-[(S)-ethoxysulfinyl]-2-pyridinyl]sulfonyl]carbamimidate IUPAC Name: N-(4,6-dimethoxypyrimidin-2-yl)-N'-[3-[(S)-ethoxysulfinyl]pyridin-2-yl]sulfonylcarbamimidate Traditional Name: N-(4,6-dimethoxypyrimidin-2-yl)-N'-[[3-[(S)-ethoxysulfinyl]-2-pyridyl]sulfonyl]carbamimidate Formula: C14H16N5O7S2- MolecularWeight: 430.43614

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOS(=O)C1=C(N=CC=C1)S(=O)(=O)N=C(NC2=NC(=CC(=N2)OC)OC)[O-]

Isomeric SMILES

CCO[S@](=O)C1=C(N=CC=C1)S(=O)(=O)N=C(NC2=NC(=CC(=N2)OC)OC)[O-]

InChI

InChI=1S/C14H17N5O7S2/c1-4-26-27(21)9-6-5-7-15-12(9)28(22,23)19-14(20)18-13-16-10(24-2)8-11(17-13)25-3/h5-8H,4H2,1-3H3,(H2,16,17,18,19,20)/p-1/t27-/m0/s1