methyl 2-[[2-(2-methoxyphenoxy)propanoylamino]carbamothioylamino]pyridine-3-carboxylate

Systemtic Name: methyl 2-[[2-(2-methoxyphenoxy)propanoylamino]carbamothioylamino]pyridine-3-carboxylate Openeye Name: methyl 2-[[2-(2-methoxyphenoxy)propanoylamino]carbamothioylamino]pyridine-3-carboxylate CAS Name: 2-[[[[2-(2-methoxyphenoxy)-1-oxopropyl]hydrazo]-sulfanylidenemethyl]amino]-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 2-[[2-(2-methoxyphenoxy)propanoylamino]carbamothioylamino]pyridine-3-carboxylate Traditional Name: 2-[[2-(2-methoxyphenoxy)propanoylamino]thiocarbamoylamino]nicotinic acid methyl ester Formula: C18H20N4O5S MolecularWeight: 404.4402

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NNC(=S)NC1=C(C=CC=N1)C(=O)OC)OC2=CC=CC=C2OC

Isomeric SMILES

CC(C(=O)NNC(=S)NC1=C(C=CC=N1)C(=O)OC)OC2=CC=CC=C2OC

InChI

InChI=1S/C18H20N4O5S/c1-11(27-14-9-5-4-8-13(14)25-2)16(23)21-22-18(28)20-15-12(17(24)26-3)7-6-10-19-15/h4-11H,1-3H3,(H,21,23)(H2,19,20,22,28)