diethyl 5-[(6-bromanylpyrazolo[1,5-a]pyrimidin-3-yl)carbonylamino]-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 5-[(6-bromanylpyrazolo[1,5-a]pyrimidin-3-yl)carbonylamino]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: diethyl 5-[(6-bromopyrazolo[1,5-a]pyrimidine-3-carbonyl)amino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[(6-bromo-3-pyrazolo[1,5-a]pyrimidinyl)-oxomethyl]amino]-3-methylthiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-[(6-bromopyrazolo[1,5-a]pyrimidine-3-carbonyl)amino]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[(6-bromopyrazolo[1,5-a]pyrimidine-3-carbonyl)amino]-3-methyl-thiophene-2,4-dicarboxylic acid diethyl ester Formula: C18H17BrN4O5S MolecularWeight: 481.32038

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)C2=C3N=CC(=CN3N=C2)Br

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)C2=C3N=CC(=CN3N=C2)Br

InChI

InChI=1S/C18H17BrN4O5S/c1-4-27-17(25)12-9(3)13(18(26)28-5-2)29-16(12)22-15(24)11-7-21-23-8-10(19)6-20-14(11)23/h6-8H,4-5H2,1-3H3,(H,22,24)