methyl 5-[[4-[(2-methoxycarbonyl-4-methyl-thiophen-3-yl)carbamothioyl]morpholin-2-yl]methoxy]pyridine-3-carboxylate

Systemtic Name: methyl 5-[[4-[(2-methoxycarbonyl-4-methyl-thiophen-3-yl)carbamothioyl]morpholin-2-yl]methoxy]pyridine-3-carboxylate Openeye Name: methyl 5-[[4-[(2-methoxycarbonyl-4-methyl-3-thienyl)carbamothioyl]morpholin-2-yl]methoxy]pyridine-3-carboxylate CAS Name: 5-[[4-[[(2-methoxycarbonyl-4-methyl-3-thiophenyl)amino]-sulfanylidenemethyl]-2-morpholinyl]methoxy]-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 5-[[4-[(2-methoxycarbonyl-4-methylthiophen-3-yl)carbamothioyl]morpholin-2-yl]methoxy]pyridine-3-carboxylate Traditional Name: 5-[[4-[(2-carbomethoxy-4-methyl-3-thienyl)thiocarbamoyl]morpholin-2-yl]methoxy]nicotinic acid methyl ester Formula: C20H23N3O6S2 MolecularWeight: 465.54312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=C1NC(=S)N2CCOC(C2)COC3=CN=CC(=C3)C(=O)OC)C(=O)OC

Isomeric SMILES

CC1=CSC(=C1NC(=S)N2CCOC(C2)COC3=CN=CC(=C3)C(=O)OC)C(=O)OC

InChI

InChI=1S/C20H23N3O6S2/c1-12-11-31-17(19(25)27-3)16(12)22-20(30)23-4-5-28-15(9-23)10-29-14-6-13(7-21-8-14)18(24)26-2/h6-8,11,15H,4-5,9-10H2,1-3H3,(H,22,30)