propyl 2-[(3-bromanylpyrazolo[1,5-a]pyrimidin-2-yl)carbonylamino]-5-(dimethylcarbamoyl)-4-methyl-thiophene-3-carboxylate

Systemtic Name: propyl 2-[(3-bromanylpyrazolo[1,5-a]pyrimidin-2-yl)carbonylamino]-5-(dimethylcarbamoyl)-4-methyl-thiophene-3-carboxylate Openeye Name: propyl 2-[(3-bromopyrazolo[1,5-a]pyrimidine-2-carbonyl)amino]-5-(dimethylcarbamoyl)-4-methyl-thiophene-3-carboxylate CAS Name: 2-[[(3-bromo-2-pyrazolo[1,5-a]pyrimidinyl)-oxomethyl]amino]-5-[dimethylamino(oxo)methyl]-4-methyl-3-thiophenecarboxylic acid propyl ester IUPAC Name: propyl 2-[(3-bromopyrazolo[1,5-a]pyrimidine-2-carbonyl)amino]-5-(dimethylcarbamoyl)-4-methylthiophene-3-carboxylate Traditional Name: 2-[(3-bromopyrazolo[1,5-a]pyrimidine-2-carbonyl)amino]-5-(dimethylcarbamoyl)-4-methyl-thiophene-3-carboxylic acid propyl ester Formula: C19H20BrN5O4S MolecularWeight: 494.3622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=C(SC(=C1C)C(=O)N(C)C)NC(=O)C2=NN3C=CC=NC3=C2Br

Isomeric SMILES

CCCOC(=O)C1=C(SC(=C1C)C(=O)N(C)C)NC(=O)C2=NN3C=CC=NC3=C2Br

InChI

InChI=1S/C19H20BrN5O4S/c1-5-9-29-19(28)11-10(2)14(18(27)24(3)4)30-17(11)22-16(26)13-12(20)15-21-7-6-8-25(15)23-13/h6-8H,5,9H2,1-4H3,(H,22,26)