ethyl 5-aminocarbonyl-2-[[7-(4-bromanyl-1-ethyl-pyrazol-3-yl)pyrazolo[1,5-a]pyrimidin-2-yl]carbonylamino]-4-methyl-thiophene-3-carboxylate

Systemtic Name: ethyl 5-aminocarbonyl-2-[[7-(4-bromanyl-1-ethyl-pyrazol-3-yl)pyrazolo[1,5-a]pyrimidin-2-yl]carbonylamino]-4-methyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[7-(4-bromo-1-ethyl-pyrazol-3-yl)pyrazolo[1,5-a]pyrimidine-2-carbonyl]amino]-5-carbamoyl-4-methyl-thiophene-3-carboxylate CAS Name: 2-[[[7-(4-bromo-1-ethyl-3-pyrazolyl)-2-pyrazolo[1,5-a]pyrimidinyl]-oxomethyl]amino]-5-carbamoyl-4-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[7-(4-bromo-1-ethylpyrazol-3-yl)pyrazolo[1,5-a]pyrimidine-2-carbonyl]amino]-5-carbamoyl-4-methylthiophene-3-carboxylate Traditional Name: 2-[[7-(4-bromo-1-ethyl-pyrazol-3-yl)pyrazolo[1,5-a]pyrimidine-2-carbonyl]amino]-5-carbamoyl-4-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C21H20BrN7O4S MolecularWeight: 546.397

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C2=CC=NC3=CC(=NN23)C(=O)NC4=C(C(=C(S4)C(=O)N)C)C(=O)OCC)Br

Isomeric SMILES

CCN1C=C(C(=N1)C2=CC=NC3=CC(=NN23)C(=O)NC4=C(C(=C(S4)C(=O)N)C)C(=O)OCC)Br

InChI

InChI=1S/C21H20BrN7O4S/c1-4-28-9-11(22)16(27-28)13-6-7-24-14-8-12(26-29(13)14)19(31)25-20-15(21(32)33-5-2)10(3)17(34-20)18(23)30/h6-9H,4-5H2,1-3H3,(H2,23,30)(H,25,31)