methyl 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: methyl 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: methyl 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 methyl ester IUPAC Name: methyl 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 methyl ester Formula: C20H18BrN7O4S MolecularWeight: 532.37042

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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)OC)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)OC)Br

InChI

InChI=1S/C20H18BrN7O4S/c1-4-27-8-10(21)15(26-27)12-5-6-23-13-7-11(25-28(12)13)18(30)24-19-14(20(31)32-3)9(2)16(33-19)17(22)29/h5-8H,4H2,1-3H3,(H2,22,29)(H,24,30)