ethyl 3-azanyl-5-[(4-chlorophenyl)sulfonylamino]-1-(2,2-dimethylpropanoyl)pyrazole-4-carboxylate

Systemtic Name: ethyl 3-azanyl-5-[(4-chlorophenyl)sulfonylamino]-1-(2,2-dimethylpropanoyl)pyrazole-4-carboxylate Openeye Name: ethyl 3-amino-5-[(4-chlorophenyl)sulfonylamino]-1-(2,2-dimethylpropanoyl)pyrazole-4-carboxylate CAS Name: 3-amino-5-[(4-chlorophenyl)sulfonylamino]-1-(2,2-dimethyl-1-oxopropyl)-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-amino-5-[(4-chlorophenyl)sulfonylamino]-1-(2,2-dimethylpropanoyl)pyrazole-4-carboxylate Traditional Name: 3-amino-5-[(4-chlorophenyl)sulfonylamino]-1-pivaloyl-pyrazole-4-carboxylic acid ethyl ester Formula: C17H21ClN4O5S MolecularWeight: 428.89044

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1N)C(=O)C(C)(C)C)NS(=O)(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1N)C(=O)C(C)(C)C)NS(=O)(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H21ClN4O5S/c1-5-27-15(23)12-13(19)20-22(16(24)17(2,3)4)14(12)21-28(25,26)11-8-6-10(18)7-9-11/h6-9,21H,5H2,1-4H3,(H2,19,20)