ethyl 5-azanyl-3-[(4-methylphenyl)sulfonylamino]-1-phenyl-pyrazole-4-carboxylate

Systemtic Name: ethyl 5-azanyl-3-[(4-methylphenyl)sulfonylamino]-1-phenyl-pyrazole-4-carboxylate Openeye Name: ethyl 5-amino-1-phenyl-3-(p-tolylsulfonylamino)pyrazole-4-carboxylate CAS Name: 5-amino-3-[(4-methylphenyl)sulfonylamino]-1-phenyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-3-[(4-methylphenyl)sulfonylamino]-1-phenylpyrazole-4-carboxylate Traditional Name: 5-amino-1-phenyl-3-(tosylamino)pyrazole-4-carboxylic acid ethyl ester Formula: C19H20N4O4S MolecularWeight: 400.4515

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1NS(=O)(=O)C2=CC=C(C=C2)C)C3=CC=CC=C3)N

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1NS(=O)(=O)C2=CC=C(C=C2)C)C3=CC=CC=C3)N

InChI

InChI=1S/C19H20N4O4S/c1-3-27-19(24)16-17(20)23(14-7-5-4-6-8-14)21-18(16)22-28(25,26)15-11-9-13(2)10-12-15/h4-12H,3,20H2,1-2H3,(H,21,22)