ethyl 3-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfonylamino]benzoate

Systemtic Name: ethyl 3-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfonylamino]benzoate Openeye Name: ethyl 3-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfonylamino]benzoate CAS Name: 3-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)sulfonylamino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[(3,5-dimethyl-1-phenylpyrazol-4-yl)sulfonylamino]benzoate Traditional Name: 3-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfonylamino]benzoic acid ethyl ester Formula: C20H21N3O4S MolecularWeight: 399.46344

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NS(=O)(=O)C2=C(N(N=C2C)C3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NS(=O)(=O)C2=C(N(N=C2C)C3=CC=CC=C3)C

InChI

InChI=1S/C20H21N3O4S/c1-4-27-20(24)16-9-8-10-17(13-16)22-28(25,26)19-14(2)21-23(15(19)3)18-11-6-5-7-12-18/h5-13,22H,4H2,1-3H3