N-(2,6-dimethylpyrimidin-4-yl)-4-[(4-ethoxyphenyl)sulfonylamino]benzenesulfonamide

Systemtic Name: N-(2,6-dimethylpyrimidin-4-yl)-4-[(4-ethoxyphenyl)sulfonylamino]benzenesulfonamide Openeye Name: N-(2,6-dimethylpyrimidin-4-yl)-4-[(4-ethoxyphenyl)sulfonylamino]benzenesulfonamide CAS Name: N-(2,6-dimethyl-4-pyrimidinyl)-4-[(4-ethoxyphenyl)sulfonylamino]benzenesulfonamide IUPAC Name: N-(2,6-dimethylpyrimidin-4-yl)-4-[(4-ethoxyphenyl)sulfonylamino]benzenesulfonamide Traditional Name: N-(2,6-dimethylpyrimidin-4-yl)-4-(p-phenetylsulfonylamino)benzenesulfonamide Formula: C20H22N4O5S2 MolecularWeight: 462.54248

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC(=NC(=C3)C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC(=NC(=C3)C)C

InChI

InChI=1S/C20H22N4O5S2/c1-4-29-17-7-11-19(12-8-17)30(25,26)23-16-5-9-18(10-6-16)31(27,28)24-20-13-14(2)21-15(3)22-20/h5-13,23H,4H2,1-3H3,(H,21,22,24)