N-(2-bromophenyl)-2-[2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylethanoylamino]ethanamide

Systemtic Name: N-(2-bromophenyl)-2-[2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylethanoylamino]ethanamide Openeye Name: N-(2-bromophenyl)-2-[[2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylacetyl]amino]acetamide CAS Name: N-(2-bromophenyl)-2-[[2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]-1-oxoethyl]amino]acetamide IUPAC Name: N-(2-bromophenyl)-2-[[2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanylacetyl]amino]acetamide Traditional Name: N-(2-bromophenyl)-2-[[2-[(4-methyl-6-phenyl-pyrimidin-2-yl)thio]acetyl]amino]acetamide Formula: C21H19BrN4O2S MolecularWeight: 471.37016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC(=O)NCC(=O)NC3=CC=CC=C3Br

Isomeric SMILES

CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC(=O)NCC(=O)NC3=CC=CC=C3Br

InChI

InChI=1S/C21H19BrN4O2S/c1-14-11-18(15-7-3-2-4-8-15)26-21(24-14)29-13-20(28)23-12-19(27)25-17-10-6-5-9-16(17)22/h2-11H,12-13H2,1H3,(H,23,28)(H,25,27)