4-[2-(1-methylimidazol-2-yl)sulfanylethanoylamino]-N-[4-methyl-3-(methylsulfamoyl)phenyl]benzamide

Systemtic Name: 4-[2-(1-methylimidazol-2-yl)sulfanylethanoylamino]-N-[4-methyl-3-(methylsulfamoyl)phenyl]benzamide Openeye Name: 4-[[2-(1-methylimidazol-2-yl)sulfanylacetyl]amino]-N-[4-methyl-3-(methylsulfamoyl)phenyl]benzamide CAS Name: 4-[[2-[(1-methyl-2-imidazolyl)thio]-1-oxoethyl]amino]-N-[4-methyl-3-(methylsulfamoyl)phenyl]benzamide IUPAC Name: 4-[[2-(1-methylimidazol-2-yl)sulfanylacetyl]amino]-N-[4-methyl-3-(methylsulfamoyl)phenyl]benzamide Traditional Name: 4-[[2-[(1-methylimidazol-2-yl)thio]acetyl]amino]-N-[4-methyl-3-(methylsulfamoyl)phenyl]benzamide Formula: C21H23N5O4S2 MolecularWeight: 473.56842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)NC(=O)CSC3=NC=CN3C)S(=O)(=O)NC

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)NC(=O)CSC3=NC=CN3C)S(=O)(=O)NC

InChI

InChI=1S/C21H23N5O4S2/c1-14-4-7-17(12-18(14)32(29,30)22-2)25-20(28)15-5-8-16(9-6-15)24-19(27)13-31-21-23-10-11-26(21)3/h4-12,22H,13H2,1-3H3,(H,24,27)(H,25,28)