propan-2-yl 4-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfonylamino]benzoate

Systemtic Name: propan-2-yl 4-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfonylamino]benzoate Openeye Name: isopropyl 4-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfonylamino]benzoate CAS Name: 4-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)sulfonylamino]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[(3,5-dimethyl-1-phenylpyrazol-4-yl)sulfonylamino]benzoate Traditional Name: 4-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfonylamino]benzoic acid isopropyl ester Formula: C21H23N3O4S MolecularWeight: 413.49002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)S(=O)(=O)NC3=CC=C(C=C3)C(=O)OC(C)C

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)S(=O)(=O)NC3=CC=C(C=C3)C(=O)OC(C)C

InChI

InChI=1S/C21H23N3O4S/c1-14(2)28-21(25)17-10-12-18(13-11-17)23-29(26,27)20-15(3)22-24(16(20)4)19-8-6-5-7-9-19/h5-14,23H,1-4H3