O2-ethyl O4-propan-2-yl 5-[[4,5-bis(bromanyl)-1H-pyrazol-3-yl]carbonylamino]-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: O2-ethyl O4-propan-2-yl 5-[[4,5-bis(bromanyl)-1H-pyrazol-3-yl]carbonylamino]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: O2-ethyl O4-isopropyl 5-[(4,5-dibromo-1H-pyrazole-3-carbonyl)amino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[(4,5-dibromo-1H-pyrazol-3-yl)-oxomethyl]amino]-3-methylthiophene-2,4-dicarboxylic acid O2-ethyl ester O4-propan-2-yl ester IUPAC Name: 2-O-ethyl 4-O-propan-2-yl 5-[(4,5-dibromo-1H-pyrazole-3-carbonyl)amino]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[(4,5-dibromo-1H-pyrazole-3-carbonyl)amino]-3-methyl-thiophene-2,4-dicarboxylic acid O2-ethyl ester O4-isopropyl ester Formula: C16H17Br2N3O5S MolecularWeight: 523.19628

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)NC(=O)C2=NNC(=C2Br)Br)C(=O)OC(C)C)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)NC(=O)C2=NNC(=C2Br)Br)C(=O)OC(C)C)C

InChI

InChI=1S/C16H17Br2N3O5S/c1-5-25-16(24)11-7(4)8(15(23)26-6(2)3)14(27-11)19-13(22)10-9(17)12(18)21-20-10/h6H,5H2,1-4H3,(H,19,22)(H,20,21)