4-chloranyl-N-[2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-1-methyl-benzimidazol-5-yl]benzenesulfonamide

Systemtic Name: 4-chloranyl-N-[2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-1-methyl-benzimidazol-5-yl]benzenesulfonamide Openeye Name: 4-chloro-N-[2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-1-methyl-benzimidazol-5-yl]benzenesulfonamide CAS Name: 4-chloro-N-[2-[[(4,6-dimethyl-2-pyrimidinyl)thio]methyl]-1-methyl-5-benzimidazolyl]benzenesulfonamide IUPAC Name: 4-chloro-N-[2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-1-methylbenzimidazol-5-yl]benzenesulfonamide Traditional Name: 4-chloro-N-[2-[[(4,6-dimethylpyrimidin-2-yl)thio]methyl]-1-methyl-benzimidazol-5-yl]benzenesulfonamide Formula: C21H20ClN5O2S2 MolecularWeight: 473.9988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC2=NC3=C(N2C)C=CC(=C3)NS(=O)(=O)C4=CC=C(C=C4)Cl)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC2=NC3=C(N2C)C=CC(=C3)NS(=O)(=O)C4=CC=C(C=C4)Cl)C

InChI

InChI=1S/C21H20ClN5O2S2/c1-13-10-14(2)24-21(23-13)30-12-20-25-18-11-16(6-9-19(18)27(20)3)26-31(28,29)17-7-4-15(22)5-8-17/h4-11,26H,12H2,1-3H3