ethyl 6-[1-(aminocarbonylamino)-1-oxidanylidene-propan-2-yl]sulfanyl-5-cyano-2-methyl-pyridine-3-carboxylate

Systemtic Name: ethyl 6-[1-(aminocarbonylamino)-1-oxidanylidene-propan-2-yl]sulfanyl-5-cyano-2-methyl-pyridine-3-carboxylate Openeye Name: ethyl 5-cyano-2-methyl-6-(1-methyl-2-oxo-2-ureido-ethyl)sulfanyl-pyridine-3-carboxylate CAS Name: 6-[[1-(carbamoylamino)-1-oxopropan-2-yl]thio]-5-cyano-2-methyl-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-[1-(carbamoylamino)-1-oxopropan-2-yl]sulfanyl-5-cyano-2-methylpyridine-3-carboxylate Traditional Name: 5-cyano-6-[(2-keto-1-methyl-2-ureido-ethyl)thio]-2-methyl-nicotinic acid ethyl ester Formula: C14H16N4O4S MolecularWeight: 336.36624

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(C(=C1)C#N)SC(C)C(=O)NC(=O)N)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(C(=C1)C#N)SC(C)C(=O)NC(=O)N)C

InChI

InChI=1S/C14H16N4O4S/c1-4-22-13(20)10-5-9(6-15)12(17-7(10)2)23-8(3)11(19)18-14(16)21/h5,8H,4H2,1-3H3,(H3,16,18,19,21)