ethyl 4-[[3-methyl-1-(phenylmethyl)pyrazol-4-yl]sulfonylamino]benzoate

Systemtic Name: ethyl 4-[[3-methyl-1-(phenylmethyl)pyrazol-4-yl]sulfonylamino]benzoate Openeye Name: ethyl 4-[(1-benzyl-3-methyl-pyrazol-4-yl)sulfonylamino]benzoate CAS Name: 4-[[3-methyl-1-(phenylmethyl)-4-pyrazolyl]sulfonylamino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(1-benzyl-3-methylpyrazol-4-yl)sulfonylamino]benzoate Traditional Name: 4-[(1-benzyl-3-methyl-pyrazol-4-yl)sulfonylamino]benzoic acid ethyl ester Formula: C20H21N3O4S MolecularWeight: 399.46344

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CN(N=C2C)CC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CN(N=C2C)CC3=CC=CC=C3

InChI

InChI=1S/C20H21N3O4S/c1-3-27-20(24)17-9-11-18(12-10-17)22-28(25,26)19-14-23(21-15(19)2)13-16-7-5-4-6-8-16/h4-12,14,22H,3,13H2,1-2H3