4-methyl-N-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]-3-nitro-benzenesulfonamide

Systemtic Name: 4-methyl-N-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]-3-nitro-benzenesulfonamide Openeye Name: 4-methyl-N-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]-3-nitro-benzenesulfonamide CAS Name: 4-methyl-N-[4-[(4-methyl-2-pyrimidinyl)sulfamoyl]phenyl]-3-nitrobenzenesulfonamide IUPAC Name: 4-methyl-N-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]-3-nitrobenzenesulfonamide Traditional Name: 4-methyl-N-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]-3-nitro-benzenesulfonamide Formula: C18H17N5O6S2 MolecularWeight: 463.48748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CC(=N3)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CC(=N3)C)[N+](=O)[O-]

InChI

InChI=1S/C18H17N5O6S2/c1-12-3-6-16(11-17(12)23(24)25)31(28,29)21-14-4-7-15(8-5-14)30(26,27)22-18-19-10-9-13(2)20-18/h3-11,21H,1-2H3,(H,19,20,22)