methyl 2-[(3-bromanylpyrazolo[1,5-a]pyrimidin-2-yl)carbonylamino]-5-methyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[(3-bromanylpyrazolo[1,5-a]pyrimidin-2-yl)carbonylamino]-5-methyl-thiophene-3-carboxylate Openeye Name: methyl 2-[(3-bromopyrazolo[1,5-a]pyrimidine-2-carbonyl)amino]-5-methyl-thiophene-3-carboxylate CAS Name: 2-[[(3-bromo-2-pyrazolo[1,5-a]pyrimidinyl)-oxomethyl]amino]-5-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(3-bromopyrazolo[1,5-a]pyrimidine-2-carbonyl)amino]-5-methylthiophene-3-carboxylate Traditional Name: 2-[(3-bromopyrazolo[1,5-a]pyrimidine-2-carbonyl)amino]-5-methyl-thiophene-3-carboxylic acid methyl ester Formula: C14H11BrN4O3S MolecularWeight: 395.23114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)NC(=O)C2=NN3C=CC=NC3=C2Br)C(=O)OC

Isomeric SMILES

CC1=CC(=C(S1)NC(=O)C2=NN3C=CC=NC3=C2Br)C(=O)OC

InChI

InChI=1S/C14H11BrN4O3S/c1-7-6-8(14(21)22-2)13(23-7)17-12(20)10-9(15)11-16-4-3-5-19(11)18-10/h3-6H,1-2H3,(H,17,20)