N-(4-bromanyl-2-methyl-phenyl)-2-[2-[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanylethanoylamino]ethanamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-2-[2-[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanylethanoylamino]ethanamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-2-[[2-[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanylacetyl]amino]acetamide CAS Name: N-(4-bromo-2-methylphenyl)-2-[[2-[[1-(2-methoxyethyl)-2-benzimidazolyl]thio]-1-oxoethyl]amino]acetamide IUPAC Name: N-(4-bromo-2-methylphenyl)-2-[[2-[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanylacetyl]amino]acetamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-2-[[2-[[1-(2-methoxyethyl)benzimidazol-2-yl]thio]acetyl]amino]acetamide Formula: C21H23BrN4O3S MolecularWeight: 491.40132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CNC(=O)CSC2=NC3=CC=CC=C3N2CCOC

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CNC(=O)CSC2=NC3=CC=CC=C3N2CCOC

InChI

InChI=1S/C21H23BrN4O3S/c1-14-11-15(22)7-8-16(14)24-19(27)12-23-20(28)13-30-21-25-17-5-3-4-6-18(17)26(21)9-10-29-2/h3-8,11H,9-10,12-13H2,1-2H3,(H,23,28)(H,24,27)