sodium N-[4-[methyl-(4-phenylpyrimidin-2-yl)amino]phenyl]sulfamate

Systemtic Name: sodium N-[4-[methyl-(4-phenylpyrimidin-2-yl)amino]phenyl]sulfamate Openeye Name: sodium N-[4-[methyl-(4-phenylpyrimidin-2-yl)amino]phenyl]sulfamate CAS Name: sodium N-[4-[methyl-(4-phenyl-2-pyrimidinyl)amino]phenyl]sulfamate IUPAC Name: sodium N-[4-[methyl-(4-phenylpyrimidin-2-yl)amino]phenyl]sulfamate Traditional Name: sodium N-[4-[methyl-(4-phenylpyrimidin-2-yl)amino]phenyl]sulfamate Formula: C17H15N4NaO3S MolecularWeight: 378.38077

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=C(C=C1)NS(=O)(=O)[O-])C2=NC=CC(=N2)C3=CC=CC=C3.[Na+]

Isomeric SMILES

CN(C1=CC=C(C=C1)NS(=O)(=O)[O-])C2=NC=CC(=N2)C3=CC=CC=C3.[Na+]

InChI

InChI=1S/C17H16N4O3S.Na/c1-21(15-9-7-14(8-10-15)20-25(22,23)24)17-18-12-11-16(19-17)13-5-3-2-4-6-13;/h2-12,20H,1H3,(H,22,23,24);/q;+1/p-1