sodium (4-aminophenyl)sulfonyl-(6-methoxypyrimidin-4-yl)azanide hydrate

Systemtic Name: sodium (4-aminophenyl)sulfonyl-(6-methoxypyrimidin-4-yl)azanide hydrate Openeye Name: sodium (4-aminophenyl)sulfonyl-(6-methoxypyrimidin-4-yl)azanide hydrate CAS Name: sodium (4-aminophenyl)sulfonyl-(6-methoxy-4-pyrimidinyl)azanide hydrate IUPAC Name: sodium (4-aminophenyl)sulfonyl-(6-methoxypyrimidin-4-yl)azanide hydrate Traditional Name: sodium (6-methoxypyrimidin-4-yl)-sulfanilyl-azanide hydrate Formula: C11H13N4NaO4S MolecularWeight: 320.30009

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=NC(=C1)[N-]S(=O)(=O)C2=CC=C(C=C2)N.O.[Na+]

Isomeric SMILES

COC1=NC=NC(=C1)[N-]S(=O)(=O)C2=CC=C(C=C2)N.O.[Na+]

InChI

InChI=1S/C11H11N4O3S.Na.H2O/c1-18-11-6-10(13-7-14-11)15-19(16,17)9-4-2-8(12)3-5-9;;/h2-7H,12H2,1H3;;1H2/q-1;+1;