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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23N3O4S/c1-4-14-28-21(25)17-10-12-18(13-11-17)23-29(26,27)20-15(2)22-24(16(20)3)19-8-6-5-7-9-19/h5-13,23H,4,14H2,1-3H3