ethyl 5-[(4-bromanyl-2-ethyl-3-formamido-3H-pyrazol-4-yl)carbamoyl]-3-methyl-thiophene-2-carboxylate

Systemtic Name: ethyl 5-[(4-bromanyl-2-ethyl-3-formamido-3H-pyrazol-4-yl)carbamoyl]-3-methyl-thiophene-2-carboxylate Openeye Name: ethyl 5-[(4-bromo-2-ethyl-3-formamido-3H-pyrazol-4-yl)carbamoyl]-3-methyl-thiophene-2-carboxylate CAS Name: 5-[[(4-bromo-2-ethyl-3-formamido-3H-pyrazol-4-yl)amino]-oxomethyl]-3-methyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(4-bromo-2-ethyl-3-formamido-3H-pyrazol-4-yl)carbamoyl]-3-methylthiophene-2-carboxylate Traditional Name: 5-[(4-bromo-1-ethyl-5-formamido-2-pyrazolin-4-yl)carbamoyl]-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C15H19BrN4O4S MolecularWeight: 431.30476

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(C(C=N1)(NC(=O)C2=CC(=C(S2)C(=O)OCC)C)Br)NC=O

Isomeric SMILES

CCN1C(C(C=N1)(NC(=O)C2=CC(=C(S2)C(=O)OCC)C)Br)NC=O

InChI

InChI=1S/C15H19BrN4O4S/c1-4-20-14(17-8-21)15(16,7-18-20)19-12(22)10-6-9(3)11(25-10)13(23)24-5-2/h6-8,14H,4-5H2,1-3H3,(H,17,21)(H,19,22)