5-[2-(5-morpholin-4-ylsulfonylpyridin-2-yl)sulfanylethanoylamino]benzene-1,3-dicarboxamide

Systemtic Name: 5-[2-(5-morpholin-4-ylsulfonylpyridin-2-yl)sulfanylethanoylamino]benzene-1,3-dicarboxamide Openeye Name: 5-[[2-[(5-morpholinosulfonyl-2-pyridyl)sulfanyl]acetyl]amino]benzene-1,3-dicarboxamide CAS Name: 5-[[2-[[5-(4-morpholinylsulfonyl)-2-pyridinyl]thio]-1-oxoethyl]amino]benzene-1,3-dicarboxamide IUPAC Name: 5-[[2-(5-morpholin-4-ylsulfonylpyridin-2-yl)sulfanylacetyl]amino]benzene-1,3-dicarboxamide Traditional Name: 5-[[2-[(5-morpholinosulfonyl-2-pyridyl)thio]acetyl]amino]isophthalamide Formula: C19H21N5O6S2 MolecularWeight: 479.52994

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CN=C(C=C2)SCC(=O)NC3=CC(=CC(=C3)C(=O)N)C(=O)N

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CN=C(C=C2)SCC(=O)NC3=CC(=CC(=C3)C(=O)N)C(=O)N

InChI

InChI=1S/C19H21N5O6S2/c20-18(26)12-7-13(19(21)27)9-14(8-12)23-16(25)11-31-17-2-1-15(10-22-17)32(28,29)24-3-5-30-6-4-24/h1-2,7-10H,3-6,11H2,(H2,20,26)(H2,21,27)(H,23,25)