methyl 3-(5-bromanylthiophen-2-yl)-2-(2,4-dichlorophenyl)-3,4-dihydropyrazole-5-carboxylate

Systemtic Name: methyl 3-(5-bromanylthiophen-2-yl)-2-(2,4-dichlorophenyl)-3,4-dihydropyrazole-5-carboxylate Openeye Name: methyl 3-(5-bromo-2-thienyl)-2-(2,4-dichlorophenyl)-3,4-dihydropyrazole-5-carboxylate CAS Name: 3-(5-bromo-2-thiophenyl)-2-(2,4-dichlorophenyl)-3,4-dihydropyrazole-5-carboxylic acid methyl ester IUPAC Name: methyl 3-(5-bromothiophen-2-yl)-2-(2,4-dichlorophenyl)-3,4-dihydropyrazole-5-carboxylate Traditional Name: 5-(5-bromo-2-thienyl)-1-(2,4-dichlorophenyl)-2-pyrazoline-3-carboxylic acid methyl ester Formula: C15H11BrCl2N2O2S MolecularWeight: 434.13504

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NN(C(C1)C2=CC=C(S2)Br)C3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

COC(=O)C1=NN(C(C1)C2=CC=C(S2)Br)C3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C15H11BrCl2N2O2S/c1-22-15(21)10-7-12(13-4-5-14(16)23-13)20(19-10)11-3-2-8(17)6-9(11)18/h2-6,12H,7H2,1H3