5-[2-[1-(2-propan-2-ylphenyl)imidazol-2-yl]sulfanylethanoylamino]benzene-1,3-dicarboxamide

Systemtic Name: 5-[2-[1-(2-propan-2-ylphenyl)imidazol-2-yl]sulfanylethanoylamino]benzene-1,3-dicarboxamide Openeye Name: 5-[[2-[1-(2-isopropylphenyl)imidazol-2-yl]sulfanylacetyl]amino]benzene-1,3-dicarboxamide CAS Name: 5-[[1-oxo-2-[[1-(2-propan-2-ylphenyl)-2-imidazolyl]thio]ethyl]amino]benzene-1,3-dicarboxamide IUPAC Name: 5-[[2-[1-(2-propan-2-ylphenyl)imidazol-2-yl]sulfanylacetyl]amino]benzene-1,3-dicarboxamide Traditional Name: 5-[[2-[(1-o-cumenylimidazol-2-yl)thio]acetyl]amino]isophthalamide Formula: C22H23N5O3S MolecularWeight: 437.51472

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1N2C=CN=C2SCC(=O)NC3=CC(=CC(=C3)C(=O)N)C(=O)N

Isomeric SMILES

CC(C)C1=CC=CC=C1N2C=CN=C2SCC(=O)NC3=CC(=CC(=C3)C(=O)N)C(=O)N

InChI

InChI=1S/C22H23N5O3S/c1-13(2)17-5-3-4-6-18(17)27-8-7-25-22(27)31-12-19(28)26-16-10-14(20(23)29)9-15(11-16)21(24)30/h3-11,13H,12H2,1-2H3,(H2,23,29)(H2,24,30)(H,26,28)