ethyl 5-[[4-bromanyl-1-[(3,4-dichlorophenyl)methyl]pyrazol-3-yl]carbamoyl]-2-methyl-pyrazole-3-carboxylate

Systemtic Name: ethyl 5-[[4-bromanyl-1-[(3,4-dichlorophenyl)methyl]pyrazol-3-yl]carbamoyl]-2-methyl-pyrazole-3-carboxylate Openeye Name: ethyl 5-[[4-bromo-1-[(3,4-dichlorophenyl)methyl]pyrazol-3-yl]carbamoyl]-2-methyl-pyrazole-3-carboxylate CAS Name: 5-[[[4-bromo-1-[(3,4-dichlorophenyl)methyl]-3-pyrazolyl]amino]-oxomethyl]-2-methyl-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[[4-bromo-1-[(3,4-dichlorophenyl)methyl]pyrazol-3-yl]carbamoyl]-2-methylpyrazole-3-carboxylate Traditional Name: 5-[[4-bromo-1-(3,4-dichlorobenzyl)pyrazol-3-yl]carbamoyl]-2-methyl-pyrazole-3-carboxylic acid ethyl ester Formula: C18H16BrCl2N5O3 MolecularWeight: 501.16134

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=NN1C)C(=O)NC2=NN(C=C2Br)CC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

CCOC(=O)C1=CC(=NN1C)C(=O)NC2=NN(C=C2Br)CC3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C18H16BrCl2N5O3/c1-3-29-18(28)15-7-14(23-25(15)2)17(27)22-16-11(19)9-26(24-16)8-10-4-5-12(20)13(21)6-10/h4-7,9H,3,8H2,1-2H3,(H,22,24,27)