ethyl 5-[bis(methylsulfonyl)amino]-1-(2,4-dichlorophenyl)pyrazole-4-carboxylate

Systemtic Name: ethyl 5-[bis(methylsulfonyl)amino]-1-(2,4-dichlorophenyl)pyrazole-4-carboxylate Openeye Name: ethyl 5-[bis(methylsulfonyl)amino]-1-(2,4-dichlorophenyl)pyrazole-4-carboxylate CAS Name: 5-[bis(methylsulfonyl)amino]-1-(2,4-dichlorophenyl)-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[bis(methylsulfonyl)amino]-1-(2,4-dichlorophenyl)pyrazole-4-carboxylate Traditional Name: 1-(2,4-dichlorophenyl)-5-(dimesylamino)pyrazole-4-carboxylic acid ethyl ester Formula: C14H15Cl2N3O6S2 MolecularWeight: 456.3214

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=C(C=C(C=C2)Cl)Cl)N(S(=O)(=O)C)S(=O)(=O)C

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=C(C=C(C=C2)Cl)Cl)N(S(=O)(=O)C)S(=O)(=O)C

InChI

InChI=1S/C14H15Cl2N3O6S2/c1-4-25-14(20)10-8-17-18(12-6-5-9(15)7-11(12)16)13(10)19(26(2,21)22)27(3,23)24/h5-8H,4H2,1-3H3