butyl 4-[(1-cyclopentyl-3-phenyl-pyrazol-4-yl)sulfonylamino]benzoate

Systemtic Name: butyl 4-[(1-cyclopentyl-3-phenyl-pyrazol-4-yl)sulfonylamino]benzoate Openeye Name: butyl 4-[(1-cyclopentyl-3-phenyl-pyrazol-4-yl)sulfonylamino]benzoate CAS Name: 4-[(1-cyclopentyl-3-phenyl-4-pyrazolyl)sulfonylamino]benzoic acid butyl ester IUPAC Name: butyl 4-[(1-cyclopentyl-3-phenylpyrazol-4-yl)sulfonylamino]benzoate Traditional Name: 4-[(1-cyclopentyl-3-phenyl-pyrazol-4-yl)sulfonylamino]benzoic acid butyl ester Formula: C25H29N3O4S MolecularWeight: 467.58046

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CN(N=C2C3=CC=CC=C3)C4CCCC4

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CN(N=C2C3=CC=CC=C3)C4CCCC4

InChI

InChI=1S/C25H29N3O4S/c1-2-3-17-32-25(29)20-13-15-21(16-14-20)27-33(30,31)23-18-28(22-11-7-8-12-22)26-24(23)19-9-5-4-6-10-19/h4-6,9-10,13-16,18,22,27H,2-3,7-8,11-12,17H2,1H3