methyl 5-[[4-[2-(dimethylcarbamothioylsulfanyl)ethanoyl]morpholin-2-yl]methoxy]pyridine-3-carboxylate

Systemtic Name: methyl 5-[[4-[2-(dimethylcarbamothioylsulfanyl)ethanoyl]morpholin-2-yl]methoxy]pyridine-3-carboxylate Openeye Name: methyl 5-[[4-[2-(dimethylcarbamothioylsulfanyl)acetyl]morpholin-2-yl]methoxy]pyridine-3-carboxylate CAS Name: 5-[[4-[2-[[dimethylamino(sulfanylidene)methyl]thio]-1-oxoethyl]-2-morpholinyl]methoxy]-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 5-[[4-[2-(dimethylcarbamothioylsulfanyl)acetyl]morpholin-2-yl]methoxy]pyridine-3-carboxylate Traditional Name: 5-[[4-[2-(dimethylthiocarbamoylthio)acetyl]morpholin-2-yl]methoxy]nicotinic acid methyl ester Formula: C17H23N3O5S2 MolecularWeight: 413.51162

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=S)SCC(=O)N1CCOC(C1)COC2=CN=CC(=C2)C(=O)OC

Isomeric SMILES

CN(C)C(=S)SCC(=O)N1CCOC(C1)COC2=CN=CC(=C2)C(=O)OC

InChI

InChI=1S/C17H23N3O5S2/c1-19(2)17(26)27-11-15(21)20-4-5-24-14(9-20)10-25-13-6-12(7-18-8-13)16(22)23-3/h6-8,14H,4-5,9-11H2,1-3H3