2-[3-(aminomethyl)phenyl]-N-[3-(tert-butylsulfamoyl)-2-fluoranyl-4-phenyl-phenyl]-5-ethyl-pyrazole-3-carboxamide

Systemtic Name: 2-[3-(aminomethyl)phenyl]-N-[3-(tert-butylsulfamoyl)-2-fluoranyl-4-phenyl-phenyl]-5-ethyl-pyrazole-3-carboxamide Openeye Name: 2-[3-(aminomethyl)phenyl]-N-[3-(tert-butylsulfamoyl)-2-fluoro-4-phenyl-phenyl]-5-ethyl-pyrazole-3-carboxamide CAS Name: 2-[3-(aminomethyl)phenyl]-N-[3-(tert-butylsulfamoyl)-2-fluoro-4-phenylphenyl]-5-ethyl-3-pyrazolecarboxamide IUPAC Name: 2-[3-(aminomethyl)phenyl]-N-[3-(tert-butylsulfamoyl)-2-fluoro-4-phenylphenyl]-5-ethylpyrazole-3-carboxamide Traditional Name: 2-[3-(aminomethyl)phenyl]-N-[3-(tert-butylsulfamoyl)-2-fluoro-4-phenyl-phenyl]-5-ethyl-pyrazole-3-carboxamide Formula: C29H32FN5O3S MolecularWeight: 549.659483

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(=C1)C(=O)NC2=C(C(=C(C=C2)C3=CC=CC=C3)S(=O)(=O)NC(C)(C)C)F)C4=CC=CC(=C4)CN

Isomeric SMILES

CCC1=NN(C(=C1)C(=O)NC2=C(C(=C(C=C2)C3=CC=CC=C3)S(=O)(=O)NC(C)(C)C)F)C4=CC=CC(=C4)CN

InChI

InChI=1S/C29H32FN5O3S/c1-5-21-17-25(35(33-21)22-13-9-10-19(16-22)18-31)28(36)32-24-15-14-23(20-11-7-6-8-12-20)27(26(24)30)39(37,38)34-29(2,3)4/h6-17,34H,5,18,31H2,1-4H3,(H,32,36)