propyl 2-[[3-(4-bromanylpyrazol-1-yl)-2-methyl-propanoyl]amino]-5-(dimethylcarbamoyl)-4-methyl-thiophene-3-carboxylate

Systemtic Name: propyl 2-[[3-(4-bromanylpyrazol-1-yl)-2-methyl-propanoyl]amino]-5-(dimethylcarbamoyl)-4-methyl-thiophene-3-carboxylate Openeye Name: propyl 2-[[3-(4-bromopyrazol-1-yl)-2-methyl-propanoyl]amino]-5-(dimethylcarbamoyl)-4-methyl-thiophene-3-carboxylate CAS Name: 2-[[3-(4-bromo-1-pyrazolyl)-2-methyl-1-oxopropyl]amino]-5-[dimethylamino(oxo)methyl]-4-methyl-3-thiophenecarboxylic acid propyl ester IUPAC Name: propyl 2-[[3-(4-bromopyrazol-1-yl)-2-methylpropanoyl]amino]-5-(dimethylcarbamoyl)-4-methylthiophene-3-carboxylate Traditional Name: 2-[[3-(4-bromopyrazol-1-yl)-2-methyl-propanoyl]amino]-5-(dimethylcarbamoyl)-4-methyl-thiophene-3-carboxylic acid propyl ester Formula: C19H25BrN4O4S MolecularWeight: 485.3952

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=C(SC(=C1C)C(=O)N(C)C)NC(=O)C(C)CN2C=C(C=N2)Br

Isomeric SMILES

CCCOC(=O)C1=C(SC(=C1C)C(=O)N(C)C)NC(=O)C(C)CN2C=C(C=N2)Br

InChI

InChI=1S/C19H25BrN4O4S/c1-6-7-28-19(27)14-12(3)15(18(26)23(4)5)29-17(14)22-16(25)11(2)9-24-10-13(20)8-21-24/h8,10-11H,6-7,9H2,1-5H3,(H,22,25)