ethyl 5-[(ethylsulfanylcarbothioylamino)carbamoyl]-2,6-dimethyl-pyridine-3-carboxylate

Systemtic Name: ethyl 5-[(ethylsulfanylcarbothioylamino)carbamoyl]-2,6-dimethyl-pyridine-3-carboxylate Openeye Name: ethyl 5-[(ethylsulfanylcarbothioylamino)carbamoyl]-2,6-dimethyl-pyridine-3-carboxylate CAS Name: 5-[[[(ethylthio)-sulfanylidenemethyl]hydrazo]-oxomethyl]-2,6-dimethyl-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(ethylsulfanylcarbothioylamino)carbamoyl]-2,6-dimethylpyridine-3-carboxylate Traditional Name: 5-[[(ethylthio)carbothioylamino]carbamoyl]-2,6-dimethyl-nicotinic acid ethyl ester Formula: C14H19N3O3S2 MolecularWeight: 341.44896

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(C(=C1)C(=O)NNC(=S)SCC)C)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(C(=C1)C(=O)NNC(=S)SCC)C)C

InChI

InChI=1S/C14H19N3O3S2/c1-5-20-13(19)11-7-10(8(3)15-9(11)4)12(18)16-17-14(21)22-6-2/h7H,5-6H2,1-4H3,(H,16,18)(H,17,21)