propan-2-yl 4-[[4,5-bis(bromanyl)thiophen-2-yl]carbonylamino]-1-ethyl-pyrazole-3-carboxylate

Systemtic Name: propan-2-yl 4-[[4,5-bis(bromanyl)thiophen-2-yl]carbonylamino]-1-ethyl-pyrazole-3-carboxylate Openeye Name: isopropyl 4-[(4,5-dibromothiophene-2-carbonyl)amino]-1-ethyl-pyrazole-3-carboxylate CAS Name: 4-[[(4,5-dibromo-2-thiophenyl)-oxomethyl]amino]-1-ethyl-3-pyrazolecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[(4,5-dibromothiophene-2-carbonyl)amino]-1-ethylpyrazole-3-carboxylate Traditional Name: 4-[(4,5-dibromothiophene-2-carbonyl)amino]-1-ethyl-pyrazole-3-carboxylic acid isopropyl ester Formula: C14H15Br2N3O3S MolecularWeight: 465.1602

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15Br2N3O3S/c1-4-19-6-9(11(18-19)14(21)22-7(2)3)17-13(20)10-5-8(15)12(16)23-10/h5-7H,4H2,1-3H3,(H,17,20)