[[4-[(5-methylpyrimidin-2-yl)sulfamoyl]phenyl]amino]-phenyl-methanesulfonic acid

Systemtic Name: [[4-[(5-methylpyrimidin-2-yl)sulfamoyl]phenyl]amino]-phenyl-methanesulfonic acid Openeye Name: [4-[(5-methylpyrimidin-2-yl)sulfamoyl]anilino]-phenyl-methanesulfonic acid CAS Name: [4-[(5-methyl-2-pyrimidinyl)sulfamoyl]anilino]-phenylmethanesulfonic acid IUPAC Name: [4-[(5-methylpyrimidin-2-yl)sulfamoyl]anilino]-phenylmethanesulfonic acid Traditional Name: [4-[(5-methylpyrimidin-2-yl)sulfamoyl]anilino]-phenyl-methanesulfonic acid Formula: C18H18N4O5S2 MolecularWeight: 434.48932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(N=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(C3=CC=CC=C3)S(=O)(=O)O

Isomeric SMILES

CC1=CN=C(N=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(C3=CC=CC=C3)S(=O)(=O)O

InChI

InChI=1S/C18H18N4O5S2/c1-13-11-19-18(20-12-13)22-28(23,24)16-9-7-15(8-10-16)21-17(29(25,26)27)14-5-3-2-4-6-14/h2-12,17,21H,1H3,(H,19,20,22)(H,25,26,27)