ethyl 2-[(4-iodanyl-1-methyl-pyrazol-3-yl)carbonylamino]-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[(4-iodanyl-1-methyl-pyrazol-3-yl)carbonylamino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[(4-iodo-1-methyl-pyrazole-3-carbonyl)amino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[(4-iodo-1-methyl-3-pyrazolyl)-oxomethyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(4-iodo-1-methylpyrazole-3-carbonyl)amino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[(4-iodo-1-methyl-pyrazole-3-carbonyl)amino]-4,5-dimethyl-thiophene-3-carboxylic acid ethyl ester Formula: C14H16IN3O3S MolecularWeight: 433.26461

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)C2=NN(C=C2I)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)C2=NN(C=C2I)C

InChI

InChI=1S/C14H16IN3O3S/c1-5-21-14(20)10-7(2)8(3)22-13(10)16-12(19)11-9(15)6-18(4)17-11/h6H,5H2,1-4H3,(H,16,19)