ethyl 5-[(4-acetamido-3-chloranyl-phenyl)sulfonylamino]-1H-pyrazole-4-carboxylate

Systemtic Name: ethyl 5-[(4-acetamido-3-chloranyl-phenyl)sulfonylamino]-1H-pyrazole-4-carboxylate Openeye Name: ethyl 5-[(4-acetamido-3-chloro-phenyl)sulfonylamino]-1H-pyrazole-4-carboxylate CAS Name: 5-[(4-acetamido-3-chlorophenyl)sulfonylamino]-1H-pyrazole-4-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[(4-acetamido-3-chlorophenyl)sulfonylamino]-1H-pyrazole-4-carboxylate Traditional Name: 5-[(4-acetamido-3-chloro-phenyl)sulfonylamino]-1H-pyrazole-4-carboxylic acid ethyl ester Formula: C14H15ClN4O5S MolecularWeight: 386.8107

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NN=C1)NS(=O)(=O)C2=CC(=C(C=C2)NC(=O)C)Cl

Isomeric SMILES

CCOC(=O)C1=C(NN=C1)NS(=O)(=O)C2=CC(=C(C=C2)NC(=O)C)Cl

InChI

InChI=1S/C14H15ClN4O5S/c1-3-24-14(21)10-7-16-18-13(10)19-25(22,23)9-4-5-12(11(15)6-9)17-8(2)20/h4-7H,3H2,1-2H3,(H,17,20)(H2,16,18,19)