3-(4-fluorophenyl)sulfonyl-N-[1-methyl-2-[(4-methylpyrimidin-2-yl)sulfanylmethyl]benzimidazol-5-yl]propanamide

Systemtic Name: 3-(4-fluorophenyl)sulfonyl-N-[1-methyl-2-[(4-methylpyrimidin-2-yl)sulfanylmethyl]benzimidazol-5-yl]propanamide Openeye Name: 3-(4-fluorophenyl)sulfonyl-N-[1-methyl-2-[(4-methylpyrimidin-2-yl)sulfanylmethyl]benzimidazol-5-yl]propanamide CAS Name: 3-(4-fluorophenyl)sulfonyl-N-[1-methyl-2-[[(4-methyl-2-pyrimidinyl)thio]methyl]-5-benzimidazolyl]propanamide IUPAC Name: 3-(4-fluorophenyl)sulfonyl-N-[1-methyl-2-[(4-methylpyrimidin-2-yl)sulfanylmethyl]benzimidazol-5-yl]propanamide Traditional Name: 3-(4-fluorophenyl)sulfonyl-N-[1-methyl-2-[[(4-methylpyrimidin-2-yl)thio]methyl]benzimidazol-5-yl]propionamide Formula: C23H22FN5O3S2 MolecularWeight: 499.580883

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1)SCC2=NC3=C(N2C)C=CC(=C3)NC(=O)CCS(=O)(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=NC(=NC=C1)SCC2=NC3=C(N2C)C=CC(=C3)NC(=O)CCS(=O)(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H22FN5O3S2/c1-15-9-11-25-23(26-15)33-14-21-28-19-13-17(5-8-20(19)29(21)2)27-22(30)10-12-34(31,32)18-6-3-16(24)4-7-18/h3-9,11,13H,10,12,14H2,1-2H3,(H,27,30)