3-[[[4-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]phenyl]carbonylamino]carbamoyl]-N-methyl-benzenesulfonamide

Systemtic Name: 3-[[[4-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]phenyl]carbonylamino]carbamoyl]-N-methyl-benzenesulfonamide Openeye Name: 3-[[[4-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzoyl]amino]carbamoyl]-N-methyl-benzenesulfonamide CAS Name: 3-[[[[4-[[(4,6-dimethyl-2-pyrimidinyl)thio]methyl]phenyl]-oxomethyl]hydrazo]-oxomethyl]-N-methylbenzenesulfonamide IUPAC Name: 3-[[[4-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzoyl]amino]carbamoyl]-N-methylbenzenesulfonamide Traditional Name: 3-[[[4-[[(4,6-dimethylpyrimidin-2-yl)thio]methyl]benzoyl]amino]carbamoyl]-N-methyl-benzenesulfonamide Formula: C22H23N5O4S2 MolecularWeight: 485.57912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC2=CC=C(C=C2)C(=O)NNC(=O)C3=CC(=CC=C3)S(=O)(=O)NC)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC2=CC=C(C=C2)C(=O)NNC(=O)C3=CC(=CC=C3)S(=O)(=O)NC)C

InChI

InChI=1S/C22H23N5O4S2/c1-14-11-15(2)25-22(24-14)32-13-16-7-9-17(10-8-16)20(28)26-27-21(29)18-5-4-6-19(12-18)33(30,31)23-3/h4-12,23H,13H2,1-3H3,(H,26,28)(H,27,29)