N-(4-chloranyl-2,5-dimethoxy-phenyl)-4-[2-(1-methylimidazol-2-yl)sulfanylethanoylamino]benzamide

Systemtic Name: N-(4-chloranyl-2,5-dimethoxy-phenyl)-4-[2-(1-methylimidazol-2-yl)sulfanylethanoylamino]benzamide Openeye Name: N-(4-chloro-2,5-dimethoxy-phenyl)-4-[[2-(1-methylimidazol-2-yl)sulfanylacetyl]amino]benzamide CAS Name: N-(4-chloro-2,5-dimethoxyphenyl)-4-[[2-[(1-methyl-2-imidazolyl)thio]-1-oxoethyl]amino]benzamide IUPAC Name: N-(4-chloro-2,5-dimethoxyphenyl)-4-[[2-(1-methylimidazol-2-yl)sulfanylacetyl]amino]benzamide Traditional Name: N-(4-chloro-2,5-dimethoxy-phenyl)-4-[[2-[(1-methylimidazol-2-yl)thio]acetyl]amino]benzamide Formula: C21H21ClN4O4S MolecularWeight: 460.93384

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SCC(=O)NC2=CC=C(C=C2)C(=O)NC3=CC(=C(C=C3OC)Cl)OC

Isomeric SMILES

CN1C=CN=C1SCC(=O)NC2=CC=C(C=C2)C(=O)NC3=CC(=C(C=C3OC)Cl)OC

InChI

InChI=1S/C21H21ClN4O4S/c1-26-9-8-23-21(26)31-12-19(27)24-14-6-4-13(5-7-14)20(28)25-16-11-17(29-2)15(22)10-18(16)30-3/h4-11H,12H2,1-3H3,(H,24,27)(H,25,28)