N-(2-bromophenyl)-2-[2-[1-(2,3-dimethylphenyl)imidazol-2-yl]sulfanylethanoylamino]ethanamide

Systemtic Name: N-(2-bromophenyl)-2-[2-[1-(2,3-dimethylphenyl)imidazol-2-yl]sulfanylethanoylamino]ethanamide Openeye Name: N-(2-bromophenyl)-2-[[2-[1-(2,3-dimethylphenyl)imidazol-2-yl]sulfanylacetyl]amino]acetamide CAS Name: N-(2-bromophenyl)-2-[[2-[[1-(2,3-dimethylphenyl)-2-imidazolyl]thio]-1-oxoethyl]amino]acetamide IUPAC Name: N-(2-bromophenyl)-2-[[2-[1-(2,3-dimethylphenyl)imidazol-2-yl]sulfanylacetyl]amino]acetamide Traditional Name: N-(2-bromophenyl)-2-[[2-[[1-(2,3-dimethylphenyl)imidazol-2-yl]thio]acetyl]amino]acetamide Formula: C21H21BrN4O2S MolecularWeight: 473.38604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2C=CN=C2SCC(=O)NCC(=O)NC3=CC=CC=C3Br)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2C=CN=C2SCC(=O)NCC(=O)NC3=CC=CC=C3Br)C

InChI

InChI=1S/C21H21BrN4O2S/c1-14-6-5-9-18(15(14)2)26-11-10-23-21(26)29-13-20(28)24-12-19(27)25-17-8-4-3-7-16(17)22/h3-11H,12-13H2,1-2H3,(H,24,28)(H,25,27)