2-[[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]iminomethyl]-4-nitro-phenolate

Systemtic Name: 2-[[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]iminomethyl]-4-nitro-phenolate Openeye Name: 2-[[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]iminomethyl]-4-nitro-phenolate CAS Name: 2-[[4-[(4-methyl-2-pyrimidinyl)sulfamoyl]phenyl]iminomethyl]-4-nitrophenolate IUPAC Name: 2-[[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]iminomethyl]-4-nitrophenolate Traditional Name: 2-[[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]iminomethyl]-4-nitro-phenolate Formula: C18H14N5O5S- MolecularWeight: 412.39926

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1)NS(=O)(=O)C2=CC=C(C=C2)N=CC3=C(C=CC(=C3)[N+](=O)[O-])[O-]

Isomeric SMILES

CC1=NC(=NC=C1)NS(=O)(=O)C2=CC=C(C=C2)N=CC3=C(C=CC(=C3)[N+](=O)[O-])[O-]

InChI

InChI=1S/C18H15N5O5S/c1-12-8-9-19-18(21-12)22-29(27,28)16-5-2-14(3-6-16)20-11-13-10-15(23(25)26)4-7-17(13)24/h2-11,24H,1H3,(H,19,21,22)/p-1