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

Systemtic Name: ethyl 4-[methyl-[[1-(phenylmethyl)pyrazol-4-yl]methyl]sulfamoyl]benzoate Openeye Name: ethyl 4-[(1-benzylpyrazol-4-yl)methyl-methyl-sulfamoyl]benzoate CAS Name: 4-[methyl-[[1-(phenylmethyl)-4-pyrazolyl]methyl]sulfamoyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(1-benzylpyrazol-4-yl)methyl-methylsulfamoyl]benzoate Traditional Name: 4-[(1-benzylpyrazol-4-yl)methyl-methyl-sulfamoyl]benzoic acid ethyl ester Formula: C21H23N3O4S MolecularWeight: 413.49002

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N(C)CC2=CN(N=C2)CC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N(C)CC2=CN(N=C2)CC3=CC=CC=C3

InChI

InChI=1S/C21H23N3O4S/c1-3-28-21(25)19-9-11-20(12-10-19)29(26,27)23(2)14-18-13-22-24(16-18)15-17-7-5-4-6-8-17/h4-13,16H,3,14-15H2,1-2H3