4-[2-(1-methylimidazol-2-yl)sulfanylethanoylamino]-N-(6-morpholin-4-ylpyridin-3-yl)benzamide

Systemtic Name: 4-[2-(1-methylimidazol-2-yl)sulfanylethanoylamino]-N-(6-morpholin-4-ylpyridin-3-yl)benzamide Openeye Name: 4-[[2-(1-methylimidazol-2-yl)sulfanylacetyl]amino]-N-(6-morpholino-3-pyridyl)benzamide CAS Name: 4-[[2-[(1-methyl-2-imidazolyl)thio]-1-oxoethyl]amino]-N-[6-(4-morpholinyl)-3-pyridinyl]benzamide IUPAC Name: 4-[[2-(1-methylimidazol-2-yl)sulfanylacetyl]amino]-N-(6-morpholin-4-ylpyridin-3-yl)benzamide Traditional Name: 4-[[2-[(1-methylimidazol-2-yl)thio]acetyl]amino]-N-(6-morpholino-3-pyridyl)benzamide Formula: C22H24N6O3S MolecularWeight: 452.52936

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SCC(=O)NC2=CC=C(C=C2)C(=O)NC3=CN=C(C=C3)N4CCOCC4

Isomeric SMILES

CN1C=CN=C1SCC(=O)NC2=CC=C(C=C2)C(=O)NC3=CN=C(C=C3)N4CCOCC4

InChI

InChI=1S/C22H24N6O3S/c1-27-9-8-23-22(27)32-15-20(29)25-17-4-2-16(3-5-17)21(30)26-18-6-7-19(24-14-18)28-10-12-31-13-11-28/h2-9,14H,10-13,15H2,1H3,(H,25,29)(H,26,30)