propyl 5-aminocarbonyl-2-[(4-bromanyl-1H-pyrazol-5-yl)carbonylamino]-4-methyl-thiophene-3-carboxylate

Systemtic Name: propyl 5-aminocarbonyl-2-[(4-bromanyl-1H-pyrazol-5-yl)carbonylamino]-4-methyl-thiophene-3-carboxylate Openeye Name: propyl 2-[(4-bromo-1H-pyrazole-5-carbonyl)amino]-5-carbamoyl-4-methyl-thiophene-3-carboxylate CAS Name: 2-[[(4-bromo-1H-pyrazol-5-yl)-oxomethyl]amino]-5-carbamoyl-4-methyl-3-thiophenecarboxylic acid propyl ester IUPAC Name: propyl 2-[(4-bromo-1H-pyrazole-5-carbonyl)amino]-5-carbamoyl-4-methylthiophene-3-carboxylate Traditional Name: 2-[(4-bromo-1H-pyrazole-5-carbonyl)amino]-5-carbamoyl-4-methyl-thiophene-3-carboxylic acid propyl ester Formula: C14H15BrN4O4S MolecularWeight: 415.2623

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=C(SC(=C1C)C(=O)N)NC(=O)C2=C(C=NN2)Br

Isomeric SMILES

CCCOC(=O)C1=C(SC(=C1C)C(=O)N)NC(=O)C2=C(C=NN2)Br

InChI

InChI=1S/C14H15BrN4O4S/c1-3-4-23-14(22)8-6(2)10(11(16)20)24-13(8)18-12(21)9-7(15)5-17-19-9/h5H,3-4H2,1-2H3,(H2,16,20)(H,17,19)(H,18,21)