ethyl 2-[[3-(4-bromanylpyrazol-1-yl)-2-methyl-propanoyl]amino]-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[3-(4-bromanylpyrazol-1-yl)-2-methyl-propanoyl]amino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[3-(4-bromopyrazol-1-yl)-2-methyl-propanoyl]amino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[3-(4-bromo-1-pyrazolyl)-2-methyl-1-oxopropyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[3-(4-bromopyrazol-1-yl)-2-methylpropanoyl]amino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[[3-(4-bromopyrazol-1-yl)-2-methyl-propanoyl]amino]-4,5-dimethyl-thiophene-3-carboxylic acid ethyl ester Formula: C16H20BrN3O3S MolecularWeight: 414.3173

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)C(C)CN2C=C(C=N2)Br

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)C(C)CN2C=C(C=N2)Br

InChI

InChI=1S/C16H20BrN3O3S/c1-5-23-16(22)13-10(3)11(4)24-15(13)19-14(21)9(2)7-20-8-12(17)6-18-20/h6,8-9H,5,7H2,1-4H3,(H,19,21)