propyl 2-[2-(4-bromanyl-3-methyl-pyrazol-1-yl)propanoylamino]-5-(dimethylcarbamoyl)-4-methyl-thiophene-3-carboxylate

Systemtic Name: propyl 2-[2-(4-bromanyl-3-methyl-pyrazol-1-yl)propanoylamino]-5-(dimethylcarbamoyl)-4-methyl-thiophene-3-carboxylate Openeye Name: propyl 2-[2-(4-bromo-3-methyl-pyrazol-1-yl)propanoylamino]-5-(dimethylcarbamoyl)-4-methyl-thiophene-3-carboxylate CAS Name: 2-[[2-(4-bromo-3-methyl-1-pyrazolyl)-1-oxopropyl]amino]-5-[dimethylamino(oxo)methyl]-4-methyl-3-thiophenecarboxylic acid propyl ester IUPAC Name: propyl 2-[2-(4-bromo-3-methylpyrazol-1-yl)propanoylamino]-5-(dimethylcarbamoyl)-4-methylthiophene-3-carboxylate Traditional Name: 2-[2-(4-bromo-3-methyl-pyrazol-1-yl)propanoylamino]-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)N2C=C(C(=N2)C)Br

Isomeric SMILES

CCCOC(=O)C1=C(SC(=C1C)C(=O)N(C)C)NC(=O)C(C)N2C=C(C(=N2)C)Br

InChI

InChI=1S/C19H25BrN4O4S/c1-7-8-28-19(27)14-10(2)15(18(26)23(5)6)29-17(14)21-16(25)12(4)24-9-13(20)11(3)22-24/h9,12H,7-8H2,1-6H3,(H,21,25)